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STK596389
Synonyms: ethyl4-(benzyloxy)[1,4]benzodioxino[2,3-b]quinoxaline-2-carboxylate
Smiles: CCOC(=O)c1cc(OCc2ccccc2)c2c(c1)Oc1c(O2)nc2c(n1)cccc2

STK596390
Synonyms: 8,8-dimethyl-3-(methylsulfanyl)-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Smiles: N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccccc1)c(SC)nn2

STK596391
Synonyms: (2'S,3S,3'S,10b'R)-3'-(2,2-dimethylpropanoyl)-2'-[(2-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccccc1C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C

STK596392
Synonyms: 2-(6-methoxy-1,3-benzothiazol-2-yl)-1-(pyridin-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccnc1)c(=O)c1c(o2)cccc1

STK596393
Synonyms: 4-[2-chloro-5-(trifluoromethyl)phenyl]-5-[3-(furan-2-yl)-1H-pyrazol-5-yl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(cc1n1c(=S)[nH]nc1c1[nH]nc(c1)c1ccco1)C(F)(F)F

STK596396
Synonyms: N-(2-methoxyphenyl)-2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1ccccc1OC

STK596398
Synonyms: 9-benzyl-5-methyl-2-[4-(propan-2-yloxy)phenyl]-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC(Oc1ccc(cc1)c1nn2c(n1)c1c(nc2C)sc2c1CCN(C2)Cc1ccccc1)C

STK596399
Synonyms: 2-{[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)C

STK596400
Synonyms: 2-{[2-(biphenyl-4-yl)-2-oxoethyl]sulfanyl}-3-(4-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)c2ccccc2)nc2c(c1=O)c1CCCCc1s2

STK596402
Synonyms: (4E)-4-({[(1-ethylpyrrolidin-2-yl)methyl]amino}methylidene)-2-(2-fluorophenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccccc1F

STK596403
Synonyms: (1S)-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}-3-methylbutan-1-amine
Smiles: CC(C[C@@H](c1nnc(o1)SCc1ccccc1F)N)C

STK596404
Synonyms: (4E)-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(3-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)O)c1nnc(s1)SCc1ccccc1F)/O

STK596406
Synonyms: 7-(2-methoxyphenyl)-5-methylbenzimidazo[1',2':1,6]pyrimido[4,5-b]quinolin-14(5H)-one
Smiles: COc1ccccc1c1nc2n(C)c3ccccc3c(=O)c2c2n1c1ccccc1n2

STK596407
Synonyms: methylN-{(E)-[1-(2,5-dimethoxyphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=O)N=C(N(C1=O)c1cc(OC)ccc1OC)S

STK596408
Synonyms: 3-{5-chloro-6-oxo-4-[(2-phenylethyl)amino]pyridazin-1(6H)-yl}tricyclo[3.3.1.1~3,7~]decane-1-carboxylicacid
Smiles: OC(=O)C12CC3CC(C1)CC(C2)(C3)n1ncc(c(c1=O)Cl)NCCc1ccccc1

STK596409
Synonyms: (2Z)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-oxo-2-(2,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cc(OC)c(cc1OC)OC)/C2=O

STK596410
Synonyms: 4-{[(E)-(4-chlorophenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)Cl

STK596412
Synonyms: N-[5-hydroxy-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-2-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)CC(=O)Nc1cc(O)nc2n1nc(n2)c1ccccc1C

STK596413
Synonyms: (E)-{2-(4-bromophenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-nitrophenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/[O-])/C1c1ccc(cc1)Br)CC

STK596414
Synonyms: 1,3-dimethyl-8-[(3-methylpiperidin-1-yl)methyl]-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCCN(C1)Cc1nc2c(n1CCc1ccccc1)c(=O)n(c(=O)n2C)C

STK596415
Synonyms: N-[2-(difluoromethoxy)phenyl]-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1ccccc1OC(F)F

STK596416
Synonyms: 8-(2,4-dimethoxyphenyl)-1-methyl-3-[(2E)-3-phenylprop-2-en-1-yl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1cc(OC)ccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)C/C=C/c1ccccc1

STK596417
Synonyms: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK596419
Synonyms: (2S)-N-(2-bromophenyl)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: Brc1ccccc1NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C(C)C

STK596420
Synonyms: ethyl(2E)-2-[(5-cyano-4-phenylpyrimidin-2-yl)imino]-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1s/c(=N/c2ncc(c(n2)c2ccccc2)C#N)/[nH]c1C

STK596421
Synonyms: 5-(3-methoxyphenyl)-4-{[(E)-(4-methoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC

STK596423
Synonyms: 2-[(5Z)-5-(4-fluorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide
Smiles: O=C(CN1C(=O)S/C(=C\c2ccc(cc2)F)/C1=O)NCCc1c[nH]c2c1cccc2

STK596424
Synonyms: (3R,3'S,5'R)-N-(2,5-dimethoxyphenyl)-5'-(4-hydroxybenzyl)-5,7-dimethyl-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: COc1ccc(c(c1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1C)Cc1ccc(cc1)O)OC

STK596425
Synonyms: 2-(2-methylphenyl)-3-phenyl-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: Cc1ccccc1c1nc2oc3ccccc3c(=O)c2c(=O)n1c1ccccc1

STK596426
Synonyms: N-(4-methoxyphenyl)-2-[(11-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CCC(C3)C

STK596427
Synonyms: 2-{[4-amino-5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1C)C)CSc1nnc(n1N)c1ccc(cc1)F

STK596428
Synonyms: (3a'S,6a'R)-5'-tert-butyl-3'-(1H-indol-3-ylmethyl)-5-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Cc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C(C)(C)C)Cc1c[nH]c3c1cccc3)C(=O)N2

STK596429
Synonyms: 3-methylbutyl(2E)-4-methyl-2-{[(4-oxo-4H-chromen-2-yl)carbonyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CC(CCOC(=O)c1s/c(=N/C(=O)c2cc(=O)c3c(o2)cccc3)/[nH]c1C)C

STK596430
Synonyms: 3-[3-(4-chlorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(3-hydroxypropyl)propanamide
Smiles: OCCCNC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Cl

STK596434
Synonyms: N,N-diethyl-6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: CCN(c1nc(SC)nc2c1c1CC(C)(C)OCc1s2)CC

STK596437
Synonyms: N-[(2Z)-1,3-benzoxazol-2(3H)-ylidene]-5-(propan-2-yl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: CC(N1CNC(=NC1)/N=c/1\oc2c([nH]1)cccc2)C

STK596438
Synonyms: 2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2OC)nnc1c1ccccc1Cl

STK596439
Synonyms: 7-butyl-14H-chromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-14-one
Smiles: CCCCc1nc2oc3ccccc3c(=O)c2c2n1c1ccccc1n2

STK596442
Synonyms: 8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C)C

STK596443
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-chlorophenyl)carbonyl]-2'-{[3-(prop-2-en-1-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: C=CCOc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK596444
Synonyms: 2-[(2E)-{[1-(2-fluorobenzyl)-1H-indol-3-yl]methylidene}hydrazinylidene]-2,3-dihydro-1H-benzimidazole
Smiles: Fc1ccccc1Cn1cc(c2c1cccc2)/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK596446
Synonyms: 9-(3,4-dimethoxyphenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1OC)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1

STK596448
Synonyms: N-[(3Z)-1-ethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-2-nitrobenzenesulfonamide
Smiles: CCn1[nH]/c(=N\S(=O)(=O)c2ccccc2[N+](=O)[O-])/c2c1nc1ccccc1c2

STK596450
Synonyms: 3-(4-chlorobenzyl)-9-(4-fluorophenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)Cl

STK596451
Synonyms: 1-[10-(3,4-dimethoxyphenyl)-2-(2-hydroxyphenyl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: COc1cc(ccc1OC)C1C(=C(C)Oc2c1c1nc(nn1cn2)c1ccccc1O)C(=O)C

STK596452
Synonyms: 2-{[2-(dimethylamino)ethyl]amino}-3-(4-fluorophenyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CN(CCNc1nc2sc3c(c2c(=O)n1c1ccc(cc1)F)CCCCC3)C

STK596454
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[4-ethyl-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1CC)SCC(=O)Nc1ccc(cc1)OCc1ccccc1

STK596456
Synonyms: (2'S,3R,3'S,7a'S)-7''-methyl-2'-[(3-nitrophenyl)carbonyl]-5',6',7',7a'-tetrahydrodispiro[indole-3,1'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: [O-][N+](=O)c1cccc(c1)C(=O)[C@@H]1[C@]2(C(=O)Nc3c2cccc3C)N2[C@H]([C@]31C(=O)Nc1c3cccc1)CCC2

STK596458
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluorophenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1cccc(c1)F

STK596459
Synonyms: 3-[(3S,3'S,3a'R,6a'S)-5-bromo-2,4',6'-trioxo-5'-(tetrahydrofuran-2-ylmethyl)-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanamide
Smiles: NC(=O)CC[C@@H]1N[C@]2([C@@H]3[C@H]1C(=O)N(C3=O)CC1CCCO1)C(=O)Nc1c2cc(Br)cc1

STK596464
Synonyms: (3a'S,6a'R)-5-bromo-5'-(3-methoxypropyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cc(Br)cc2

STK596465
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(COc2ccc(cc2)Cl)nnc1SCC(=O)N

STK596466
Synonyms: 5-(biphenyl-4-yl)-7-(3,4-dimethoxyphenyl)-3,7-dihydrotetrazolo[1,5-a]pyrimidine
Smiles: COc1cc(ccc1OC)C1C=C(N=c2n1nn[nH]2)c1ccc(cc1)c1ccccc1

STK596471
Synonyms: 1-benzyl-1'-methyl-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCC1N(C)c2ccc(cc2CC21C(=O)NC(=O)N(C2=O)Cc1ccccc1)[N+](=O)[O-]

STK596472
Synonyms: (4E)-4-[(4-bromophenyl)(hydroxy)methylidene]-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: Brc1ccc(cc1)/C(=C/1\C(=O)C(=O)NC1c1ccc(cc1)C(C)C)/O

STK596473
Synonyms: 4-hydroxy-5-(4-methoxyphenyl)-2-(methylsulfanyl)-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: COc1ccc(cc1)C1CC(=O)Nc2c1c(O)nc(n2)SC

STK596474
Synonyms: (2'S,3S,3'S,10b'R)-3'-(2,2-dimethylpropanoyl)-2'-[(3,4,5-trimethoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1c(OC)cc(cc1OC)C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C

STK596476
Synonyms: 2-amino-6-(2-methoxybenzyl)-7-methyl-5-oxo-4-(pyridin-4-yl)-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccncc1)c(=O)n(c(c2)C)Cc1ccccc1OC

STK596478
Synonyms: 7-(4-fluorophenyl)-3-(4-methylphenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: Cc1ccc(cc1)C1=NOC2(C1)CC(=O)N(C2=O)c1ccc(cc1)F

STK596480
Synonyms: 3-[(3R,3'S,3a'S,6a'R)-5'-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanoicacid
Smiles: N#Cc1c(sc2c1CCCC2)N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@H]2CCC(=O)O)C(=O)Nc2c1cccc2

STK596481
Synonyms: (6E)-4-(1-benzofuran-2-yl)-6-{[3-(trifluoromethyl)phenyl]imino}-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: Nc1[nH]/c(=N\c2cccc(c2)C(F)(F)F)/nc(n1)c1cc2c(o1)cccc2

STK596483
Synonyms: 5-(1,3-benzodioxol-5-ylmethyl)-N-[(2E)-4-methylquinazolin-2(1H)-ylidene]-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: Cc1n/c(=N/C2=NCN(CN2)Cc2ccc3c(c2)OCO3)/[nH]c2c1cccc2

STK596485
Synonyms: 3-{(2S)-1-[4-(4-fluorophenyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl}-1,2,3-benzotriazin-4(3H)-one
Smiles: CC([C@H](n1nnc2c(c1=O)cccc2)C(=O)N1CCN(CC1)c1ccc(cc1)F)C

STK596487
Synonyms: (5E)-5-[4-(benzyloxy)-3-chloro-5-methoxybenzylidene]-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C\c2cc(Cl)c(c(c2)OC)OCc2ccccc2)/C1=O)O

STK596489
Synonyms: (4E)-5-(4-fluorophenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
Smiles: C=CCSc1nnc(s1)N1C(c2ccc(cc2)F)/C(=C(/c2ccco2)\O)/C(=O)C1=O

STK596491
Synonyms: N-[4-(diethylamino)phenyl]-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1)CC

STK596493
Synonyms: 5-ethoxy-N'-[(E)-(3-methoxyphenyl)methylidene]-1H-indole-2-carbohydrazide
Smiles: CCOc1ccc2c(c1)cc([nH]2)C(=O)N/N=C/c1cccc(c1)OC

STK596495
Synonyms: N-(2-ethylphenyl)-2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK596496
Synonyms: 3-chloro-N-[(1Z)-1-{1-cyano-2-[(3-methylbutyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cccc(c1)Cl)/C(=O)NCCC(C)C

STK596498
Synonyms: 6-[2-(hydroxymethyl)phenyl]-5-(4-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: COc1ccc(cc1)c1n(cc2c1c(=O)n(C)c(=O)n2C)c1ccccc1CO

STK596499
Synonyms: N'-[(1Z)-1-(4-fluorophenyl)ethylidene]-5-{4-[(4-methylbenzyl)oxy]phenyl}-1H-pyrazole-3-carbohydrazide
Smiles: Cc1ccc(cc1)COc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C(\c1ccc(cc1)F)/C

STK596501
Synonyms: 4-{[(E)-(3-bromophenyl)methylidene]amino}-5-[4-(dimethylamino)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)N(C)C

STK596502
Synonyms: N-[(2E)-5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-ethoxybenzamide
Smiles: CCOc1ccc(cc1)C(=O)/N=c/1\[nH]nc(s1)c1ccc(c(c1)OC)OC

STK596506
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2-chlorophenyl)carbonyl]-2'-[(2,5-dimethoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)OC

STK596507
Synonyms: 5-[2-(4-ethylpiperazin-1-yl)benzylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCN1CCN(CC1)c1ccccc1C=C1C(=O)N(C)C(=O)N(C1=O)C

STK596508
Synonyms: (5E)-2-(2,4-dichlorophenyl)-5-(furan-2-ylmethylidene)-3-methyl-3,5-dihydro-4H-imidazol-4-one
Smiles: Clc1ccc(c(c1)Cl)C1=N/C(=C/c2ccco2)/C(=O)N1C

STK596510
Synonyms: 4-(3,4-dichlorophenyl)-N-(3-methoxyphenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)C)CCCC3)c1ccc(c(c1)Cl)Cl

STK596512
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-5-[3-methoxy-4-(3-methylbutoxy)phenyl]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK596513
Synonyms: N-(4-methoxyphenyl)-1-(3-methoxypropyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)Nc1ccc(cc1)OC

STK596514
Synonyms: 5-(3-ethoxyphenyl)-4-{[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/C(=C/c1ccccc1)/C

STK596515
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(thiophen-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccs1)c(=O)c1c(o2)cccc1

STK596516
Synonyms: 2-(4-chlorophenyl)-N-[N-(6-ethoxy-4-methylquinazolin-2-yl)carbamimidoyl]acetamide
Smiles: CCOc1ccc2c(c1)c(C)nc(n2)NC(=N)NC(=O)Cc1ccc(cc1)Cl

STK596518
Synonyms: 2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)c1ccccc1

STK596519
Synonyms: 2-(3,4-dimethoxyphenyl)-5,10,10-trimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2

STK596520
Synonyms: methyl2-({(Z)-2-cyano-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5-dimethylthiophene-3-carboxylate
Smiles: N#C/C(=C/Nc1sc(c(c1C(=O)OC)C)C)/c1scc(n1)c1cc2ccccc2oc1=O

STK596521
Synonyms: (3R,3'S,5'R)-5-bromo-N-(4-methoxyphenyl)-2-oxo-5'-(propan-2-yl)-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(Br)cc1)C(C)C

STK596523
Synonyms: 2-[4-(biphenyl-4-yloxy)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Oc2ccc(cc2)c2ccccc2)c2c(n1)cccc2

STK596524
Synonyms: 6-[(2-methylpiperidinium-1-yl)methyl]-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCCC1C)oc(=O)c1c2CCC1

STK596525
Synonyms: 8-[(4-methoxyphenyl)sulfonyl]-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK596527
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-chlorophenyl)carbonyl]-2'-(phenylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)cccc3

STK596528
Synonyms: methyl4-[({[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)OC)nnc1c1ccc(cc1)C(C)(C)C

STK596530
Synonyms: N-(biphenyl-2-yl)-2-{[3-(4-ethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2c2ccccc2)nc2c(c1=O)cccc2

STK596531
Synonyms: 4-{[(E)-(2,3-dichlorophenyl)methylidene]amino}-5-(4-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cccc(c1Cl)Cl

STK596533
Synonyms: N-[1-methyl-4-oxo-3-(3,4,5-trimethoxyphenyl)-1,4-dihydroquinolin-2-yl]benzamide
Smiles: COc1cc(cc(c1OC)OC)c1c(NC(=O)c2ccccc2)n(C)c2c(c1=O)cccc2

STK596534
Synonyms: N-(2-bromophenyl)-2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1Br)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK596535
Synonyms: 3-ethyl-2'-hydroxy-1'-(4-methoxyphenyl)-8-nitro-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: CCN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)c1ccc(cc1)OC)O

STK596536
Synonyms: 2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1

STK596540
Synonyms: 2-{[5-(2-aminoethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(4-chlorophenyl)ethanone
Smiles: NCCc1nnc(o1)SCC(=O)c1ccc(cc1)Cl

STK596541
Synonyms: methylN-[(2-ethylphenyl)carbamoyl]-L-phenylalaninate
Smiles: COC(=O)[C@@H](NC(=O)Nc1ccccc1CC)Cc1ccccc1

STK596543
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[4-ethyl-5-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)OCc2ccccc2)nnc1c1ccccc1F

STK596544
Synonyms: methyl4-[({[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccc(cc1)C(=O)OC

STK596545
Synonyms: (3a'S,6a'R)-3'-(1-hydroxyethyl)-5'-(2-methoxyethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cccc2

STK596546
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(2-chlorophenyl)carbonyl]-3'-[(4-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1Cl)C(=O)Nc1c2cccc1)cccc3

STK596547
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-fluorophenyl)carbonyl]-2'-[(3-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK596548
Synonyms: N-(furan-2-ylmethyl)-2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCc1ccco1

STK596550
Synonyms: 4-(3-chlorophenyl)-8-methyl-1-[(2-phenylethyl)sulfanyl]-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCCc1ccccc1)nn2)c1cccc(c1)Cl

STK596551
Synonyms: 10-(3-hydroxypropyl)-7-methyl-1,2,3,4,10,11-hexahydro-5H,9H-benzo[3,4]chromeno[6,7-e][1,3]oxazin-5-one
Smiles: OCCCN1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCCC2

STK596552
Synonyms: (4E)-1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)CSc1nnc(s1)N1C(c2ccc(cc2)C(C)C)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=O

STK596553
Synonyms: 4-[({1-[2-(2-chlorophenoxy)ethyl]-1H-benzimidazol-2-yl}methyl)ammonio]benzoate
Smiles: Clc1ccccc1OCCn1c(C[NH2+]c2ccc(cc2)C(=O)[O-])nc2c1cccc2

STK596555
Synonyms: 2-(3-hydroxy-5-methyl-4H-pyrazol-4-yl)-N'-[(E)-(4-nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CC1C(=NN=C1O)C)N/N=C/c1ccc(cc1)[N+](=O)[O-]

STK596557
Synonyms: (5Z)-6-hydroxy-5-[(2E)-1-hydroxy-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C(\C=C\c2ccccc2OC)/O)/C1=O)O

STK596559
Synonyms: 3-(1H-benzimidazol-1-yl)-N-(2-phenylethyl)propanamide
Smiles: O=C(CCn1cnc2c1cccc2)NCCc1ccccc1

STK596560
Synonyms: 5-(4-fluorophenyl)-4-{[(E)-(5-methylfuran-2-yl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(o1)C

STK596561
Synonyms: 5-(4-butoxyphenyl)-N'-[(E)-(4-methylphenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: CCCCOc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1ccc(cc1)C

STK596564
Synonyms: 5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)NC=C2C(=O)N(C)C(=O)N(C2=O)C)C(=NC(=NC1=O)O)O

STK596565
Synonyms: 3-[(2-fluorobenzyl)sulfanyl]-10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccccc1F)nn2)CC(OC3)(C)C

STK596567
Synonyms: (4Z)-4-[(3-chloro-4-methylphenyl)imino]-6-{[4-(2-methoxyphenyl)piperazin-1-yl]methyl}-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: COc1ccccc1N1CCN(CC1)Cc1nc(N)n/c(=N\c2ccc(c(c2)Cl)C)/[nH]1

STK596568
Synonyms: N-{[trans-4-({[N-(tert-butoxycarbonyl)-D-leucyl]amino}methyl)cyclohexyl]carbonyl}-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)[C@@H]1CC[C@H](CC1)CNC(=O)[C@H](NC(=O)OC(C)(C)C)CC(C)C

STK596571
Synonyms: 3-(furan-2-ylmethyl)-2-[(2-methoxyethyl)amino]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COCCNc1nc2sc3c(c2c(=O)n1Cc1ccco1)CCCCC3

STK596572
Synonyms: 5-[3-(benzyloxy)phenyl]-N'-[(1E)-1-(3,4-dichlorophenyl)ethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1)N/N=C(/c1ccc(c(c1)Cl)Cl)\C

STK596573
Synonyms: 3-(3-chlorophenyl)-5-[(naphthalen-1-ylmethyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
Smiles: Clc1cccc(c1)c1nnc(n1c1ccccc1)SCc1cccc2c1cccc2

STK596574
Synonyms: {4-[7-(4-fluorophenyl)-6,8-dioxo-1-oxa-2,7-diazaspiro[4.4]non-2-en-3-yl]-2-methoxyphenoxy}acetonitrile
Smiles: N#CCOc1ccc(cc1OC)C1=NOC2(C1)CC(=O)N(C2=O)c1ccc(cc1)F

STK596575
Synonyms: (3a'S,6a'R)-3'-(3,4-dihydroxybenzyl)-5'-(4-fluorobenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cccc2

STK596576
Synonyms: (10'R,11'R)-11'-acetyl-10'-(4-chlorophenyl)-10',11'-dihydro-8a'H-spiro[indene-2,9'-pyrrolo[1,2-a][1,10]phenanthroline]-1,3-dione
Smiles: Clc1ccc(cc1)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2c2ncccc2cc1

STK596577
Synonyms: ethyl4-(1,3,7-trimethyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyrimido[2,1-f]purin-9(6H)-yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)C

STK596580
Synonyms: N-(2,5-dimethylphenyl)-2-{[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2C)nnc1c1cccc(c1)OC

STK596581
Synonyms: 2-[5-(2-chlorophenyl)furan-2-yl]-4-hydroxy-1-phenyl-6-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile
Smiles: N#CC1=C(S)N(C(N=C1O)c1ccc(o1)c1ccccc1Cl)c1ccccc1

STK596584
Synonyms: N-[(2Z)-3-(3-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclohexanecarboxamide
Smiles: COc1cccc(c1)CN1/C(=N/C(=O)C2CCCCC2)/SC2C1CS(=O)(=O)C2

STK596585
Synonyms: 2-{[7,7-dimethyl-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Smiles: O=C(Nc1nccs1)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C

STK596586
Synonyms: 3-(2-methoxyethyl)-2-(3,4,5-trimethoxyphenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1cc(OC)c(c(c1)OC)OC

STK596587
Synonyms: N-(4-acetylphenyl)-2-({6-cyano-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamide
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)Nc3ccc(cc3)C(=O)C)nnc2c2c1CC(C)(C)OC2

STK596588
Synonyms: (4E)-4-({[(1-ethylpyrrolidin-2-yl)methyl]amino}methylidene)-2-(2-nitrophenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccccc1[N+](=O)[O-]

STK596590
Synonyms: N-[(2Z)-4-hydroxy-1,3-thiazol-2(5H)-ylidene]-2-[(4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Smiles: O=C(/N=C/1\SCC(=N1)O)CSc1sc(=S)n(n1)c1ccccc1

STK596591
Synonyms: (3E)-3-(furan-2-ylmethylidene)-4-imino-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one
Smiles: O=C1N=c2sc3c(n2C(=N)/C/1=C\c1ccco1)cccc3

STK596592
Synonyms: (1'S,3R,3'S,7a'R)-7''-chloro-1'-[(4-propoxyphenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1Cl

STK596595
Synonyms: (4E)-1-hexadecyl-4-[hydroxy(4-methylphenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: CCCCCCCCCCCCCCCCN1C(c2ccc(cc2)C)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O

STK596596
Synonyms: (3S,3'S,3a'R,6a'S)-5-fluoro-3'-(2-methylpropyl)-5'-(tetrahydrofuran-2-ylmethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC(C[C@@H]1N[C@]2([C@@H]3[C@H]1C(=O)N(C3=O)CC1CCCO1)C(=O)Nc1c2cc(F)cc1)C

STK596597
Synonyms: 2-{[4-amino-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK596600
Synonyms: 2-(hexylsulfanyl)-5-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: CCCCCCSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccc(c(c1)OC)O

STK596601
Synonyms: 13-(4-ethoxy-3-methoxyphenyl)-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one
Smiles: CCOc1ccc(cc1OC)C1C=C2N(C3=C1C(=O)CC(C3)(C)C)CCc1c2cc(OC)c(c1)OC

STK596602
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-3-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)/C1=O

STK596603
Synonyms: 4-{[(E)-(2,6-dichlorophenyl)methylidene]amino}-5-(3-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c(Cl)cccc1Cl

STK596604
Synonyms: N'-[(1E)-1-(1-benzyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)ethyl]benzohydrazide
Smiles: O=C(c1ccccc1)NN/C(=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O)/C

STK596605
Synonyms: N-(2,4-dimethylphenyl)-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccccc1)c1ccc(cc1C)C

STK596606
Synonyms: 6-hydroxy-3-methyl-8-[4-(4-methylbenzyl)piperazin-1-yl]-7-propyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccc(cc1)C

STK596608
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK596609
Synonyms: (3S,3a'R,8a'S,8b'S)-5-chloro-7-methyl-2'-(naphthalen-1-yl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Clc1cc(C)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc2c1cccc2

STK596611
Synonyms: N-[(2Z,5Z)-5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-4-hydroxy-1,3-thiazol-2(5H)-ylidene]acetamide
Smiles: CC(=O)/N=C\1/N=C(/C(=C/c2cc(n(c2C)c2ccc(cc2)[N+](=O)[O-])C)/S1)O

STK596612
Synonyms: 5-(2-methylphenyl)-4-{[(E)-(4-propoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1C

STK596613
Synonyms: N-[2-(3,4-dimethylphenyl)-4-(3-methoxyphenyl)-6-methyl-5-oxo-2,5-dihydropyridazin-3-yl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1c(c2cccc(c2)OC)c(=O)c(nn1c1ccc(c(c1)C)C)C

STK596614
Synonyms: 2-{[2-(3-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Smiles: COc1cccc(c1)c1nc(SCC(=O)Nc2nccs2)c2c(n1)CC(OC2)(C)C

STK596615
Synonyms: (3R,3'S,5'R)-5-chloro-N-(2,5-dimethoxyphenyl)-5'-(4-hydroxybenzyl)-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(Cl)cc1)Cc1ccc(cc1)O)OC

STK596616
Synonyms: N-[3-(3,4-dichlorophenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Nc1oc2ccccc2c(=O)c1c1ccc(c(c1)Cl)Cl

STK596617
Synonyms: 3-[(2,4-dichlorobenzyl)sulfanyl]-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)c1nnc(n1c1ccccc1)SCc1ccc(cc1Cl)Cl

STK596618
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-nitrophenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/[O-])/C1c1ccc(cc1)OC)CC

STK596619
Synonyms: 2-[(3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(2-methoxyethyl)acetamide
Smiles: COCCNC(=O)COc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1

STK596620
Synonyms: (3a'S,6a'R)-5'-(3-methoxypropyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cccc2

STK596621
Synonyms: (1S)-1-{5-[(3-chlorobenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}-3-methylbutan-1-amine
Smiles: CC(C[C@@H](c1nnc(o1)SCc1cccc(c1)Cl)N)C

STK596624
Synonyms: 3-(4-chlorophenoxy)-5-oxo-5H-anthra[1,9-cd][1,2]oxazol-6-ylthiophene-2-carboxylate
Smiles: Clc1ccc(cc1)OC1=CC(=O)c2c3c1noc3c1c(c2OC(=O)c2cccs2)cccc1

STK596625
Synonyms: N-(2,3-dimethoxybenzyl)-5,6-dimethoxy-N-(prop-2-en-1-yl)-1H-indole-2-carboxamide
Smiles: C=CCN(C(=O)c1cc2c([nH]1)cc(c(c2)OC)OC)Cc1cccc(c1OC)OC

STK596626
Synonyms: 4-methyl-N-[(3Z)-7-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)C)/c2c1nc1cc(C)ccc1c2

STK596627
Synonyms: 2-hydroxy-1-(2-methylphenyl)-6-(1-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CC(N1CNc2c(C1)c(=O)nc(n2c1ccccc1C)O)c1ccccc1

STK596628
Synonyms: 7-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CCc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1cc(Cl)ccc1C

STK596629
Synonyms: 3-[(2,6-dichlorobenzyl)sulfanyl]-4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazole
Smiles: CCn1c(SCc2c(Cl)cccc2Cl)nnc1c1ccccc1OC

STK596632
Synonyms: 2-{[4-(3-chlorophenyl)-8-methyl-5-oxo-4,5,6,7,8,9-hexahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}-N,N-diethylacetamide
Smiles: CCN(C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)Cl)CCN(C3)C)CC

STK596633
Synonyms: (3a'S,6a'R)-3'-(1H-indol-3-ylmethyl)-5'-(4-methylphenyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2

STK596634
Synonyms: 8-methoxy-3-(4-methoxybenzyl)-2-(4-methoxyphenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COc1ccc(cc1)c1nc2oc3cc(OC)ccc3c(=O)c2c(=O)n1Cc1ccc(cc1)OC

STK596636
Synonyms: 3-(3-chlorophenyl)-7-methyl-2-(pyrrolidin-1-yl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c(n1)N1CCCC1)c1cccc(c1)Cl

STK596637
Synonyms: 4-butyl-6-chloro-2-oxo-2H-chromen-7-yl6-{[(4-methylphenyl)sulfonyl]amino}hexanoate
Smiles: CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)CCCCCNS(=O)(=O)c1ccc(cc1)C

STK596638
Synonyms: 7-chloro-1-(3-methoxyphenyl)-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cccc(c1)C1N(c2sc3c(n2)ccc(c3)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK596639
Synonyms: (1S,2S)-N'-[(E)-(2-chloro-7-methylquinolin-3-yl)methylidene]-2-phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cc2ccc(cc2nc1Cl)C

STK596640
Synonyms: 4-fluoro-N-[(3E)-7-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CCCn1[nH]/c(=N/S(=O)(=O)c2ccc(cc2)F)/c2c1nc1cc(C)ccc1c2

STK596641
Synonyms: 5-(3-ethoxyphenyl)-4-{[(E)-(3-phenoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)Oc1ccccc1

STK596643
Synonyms: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2S)-3-methyl-1-oxo-1-(piperidin-1-yl)butan-2-yl]-5-oxopyrrolidine-3-carboxamide
Smiles: CC([C@@H](C(=O)N1CCCCC1)NC(=O)C1CC(=O)N(C1)c1ccc2c(c1)OCCO2)C

STK596644
Synonyms: 3-[(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)carbonyl]-N,N-dimethylbenzenesulfonamide
Smiles: COc1cc2CCN(C(=C)c2cc1OC)C(=O)c1cccc(c1)S(=O)(=O)N(C)C

STK596646
Synonyms: 1-(2,3-dimethoxyphenyl)-2-[6-(propan-2-yl)-1,3-benzothiazol-2-yl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1c(OC)cccc1C1N(c2nc3c(s2)cc(cc3)C(C)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK596648
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-3-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2F)/C1=O

STK596649
Synonyms: 2-benzyl-1-(3-chlorophenyl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1cccc(c1)C1N(Cc2ccccc2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK596650
Synonyms: 7'-{(E)-[2-hydroxy-1-(2-methylphenyl)-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trion
Smiles: O=C1N=C(O)N(C(=O)/C/1=C/c1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)c1ccccc1C

STK596652
Synonyms: 8-cyclohexyl-4-hydroxy-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Oc1nc(=O)n(c2c1n1cc(n(c1n2)C1CCCCC1)C)C

STK596653
Synonyms: (4E)-5-(3-butoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: CCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK596654
Synonyms: 2-(4-benzylpiperazin-1-yl)-5-ethylpyrimidine-4,6-diol
Smiles: CCc1c(O)nc(nc1O)N1CCN(CC1)Cc1ccccc1

STK596655
Synonyms: 9-bromo-5-(2-fluorophenyl)-2-(3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1cccc(c1)C1=NN2C(C1)c1cc(Br)ccc1OC2c1ccccc1F

STK596656
Synonyms: 7-benzyl-1,3-dichloro-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
Smiles: N#Cc1c(Cl)nc(c2c1CCN(C2)Cc1ccccc1)Cl

STK596657
Synonyms: 5-(3,4-dimethoxyphenyl)-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)c1n[nH]c(c1)c1ccc(c(c1)OC)OC)OC

STK596658
Synonyms: methylN-({4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl}carbamoyl)-L-alaninate
Smiles: COC(=O)[C@@H](NC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1noc(c1)C)C

STK596659
Synonyms: N-(2-bromophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1ccccc1Br

STK596660
Synonyms: (5E)-6-hydroxy-5-{1-[(2-hydroxyethyl)amino]propylidene}-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: OCCN/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/CC

STK596661
Synonyms: N'-{(1E)-1-[4-hydroxy-2,6-dioxo-1-(prop-2-en-1-yl)-1,6-dihydropyrimidin-5(2H)-ylidene]propyl}benzohydrazide
Smiles: C=CCN1C(=O)N=C(/C(=C(\NNC(=O)c2ccccc2)/CC)/C1=O)O

STK596662
Synonyms: N-(furan-2-ylmethyl)-4-methoxy-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)Cc1ccco1

STK596663
Synonyms: 2-[(3a'S,6a'R)-5'-butyl-6,7-dimethyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1ccc(c2C)C

STK596665
Synonyms: N-(3-methylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-4-yl)methyl]pyridine-3-carboxamide
Smiles: Cc1cccc(c1)N(C(=O)c1cccnc1)Cc1cc(=O)[nH]c2c1cccc2

STK596667
Synonyms: N-{[3-(4-bromophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}glycylglycine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Br)NCC(=O)NCC(=O)O

STK596670
Synonyms: 3-ethyl-1'-(2-methoxyethyl)-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COCCN1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC)CC1)[N+](=O)[O-]

STK596672
Synonyms: 2-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)C)c(=O)c1c(o2)cccc1

STK596673
Synonyms: N-[(2E)-5,5-dioxido-3-(prop-2-en-1-yl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(4-fluorophenyl)acetamide
Smiles: C=CCN1/C(=N\C(=O)Cc2ccc(cc2)F)/SC2C1CS(=O)(=O)C2

STK596674
Synonyms: N-cyclohexyl-2-{[5-(methylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)NC1CCCCC1)nn2)CCC3

STK596676
Synonyms: 4-[({[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STK596677
Synonyms: 8-{[benzyl(methyl)amino]methyl}-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN(Cc1nc2c(n1Cc1ccc(cc1)F)c(=O)n(c(=O)n2C)C)Cc1ccccc1

STK596678
Synonyms: 2-benzyl-7-chloro-1-(pyridin-4-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccncc1)Cc1ccccc1

STK596680
Synonyms: methylN-[(3-chloro-4-methoxyphenyl)carbamoyl]-L-phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccc(c(c1)Cl)OC

STK596681
Synonyms: 9-(2-chlorophenyl)-6-(2-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Cc1ccccc1C1CC(=C2C(=Nc3n(C2c2ccccc2Cl)ncn3)C1)O

STK596682
Synonyms: N-benzyl-2-{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)NCc2ccccc2)c2c(n1)CC(OC2)(C)C

STK596684
Synonyms: N-(2-methoxyethyl)-2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCCOC

STK596685
Synonyms: 10-methyl-3-(1-phenylethyl)-2-(thiophen-2-yl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CC(n1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1cccs1)c1ccccc1

STK596686
Synonyms: 2-{4-(4-methoxyphenyl)-5-[(2-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Smiles: COc1ccc(cc1)n1c(nnc1c1ccccn1)SCc1ccccc1C

STK596687
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(furan-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccco1)c(=O)c1c(o2)cccc1

STK596689
Synonyms: 4-imino-9,10-dimethoxy-2-(2-methyl-1H-indol-3-yl)-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: N#Cc1c(=N)n2CCc3c(c2cc1c1c(C)[nH]c2c1cccc2)cc(c(c3)OC)OC

STK596690
Synonyms: N-[2-(2-{(E)-[1-(4-ethoxyphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-3-yl)ethyl]-N-ethylacetamide
Smiles: CCOc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2[nH]c3c(c2CCN(C(=O)C)CC)cccc3)/C1=O

STK596692
Synonyms: 6-hydroxy-3-methyl-7-(3-methylbenzyl)-8-[(naphthalen-2-ylmethyl)sulfanyl]-3,7-dihydro-2H-purin-2-one
Smiles: Cc1cccc(c1)Cn1c(SCc2ccc3c(c2)cccc3)nc2c1c(O)nc(=O)n2C

STK596693
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3-nitrophenyl)carbonyl]-2'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccs1)C(=O)Nc1c2cccc1)cccc3)c1cccc(c1)[N+](=O)[O-]

STK596696
Synonyms: N-(3,5-dimethoxyphenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(OC)cc(c2)OC)nnc1COc1ccc(cc1)C

STK596697
Synonyms: N-(3-chloro-4-methylphenyl)-2-hydroxy-7-(4-methoxyphenyl)-5-oxo-3,4,5,6,7,8-hexahydroquinoline-4-carboxamide
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)N=C(CC2C(=O)Nc1ccc(c(c1)Cl)C)O

STK596698
Synonyms: 10-methyl-3-phenyl-2-propylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCc1nc2c(c(=O)n1c1ccccc1)c(=O)c1c(n2C)cccc1

STK596699
Synonyms: (3a'S,6a'R)-7-chloro-5'-cyclopentyl-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C1CCCC1)C(=O)Nc1c2cccc1Cl

STK596700
Synonyms: (3a'S,6a'R)-5-chloro-5'-(2-chlorobenzyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Clc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(C)C)C(=O)N2

STK596701
Synonyms: 2,2-dimethyl-5-propyl-N-(tetrahydrofuran-2-ylmethyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCC1CCCO1

STK596702
Synonyms: (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[4-(propan-2-yl)phenyl]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CC1Cc2c(O1)ccc(c2)/C(=C\1/C(c2ccc(cc2)C(C)C)N(C(=O)C1=O)c1nccs1)/O

STK596703
Synonyms: N-[(2E)-3-(3-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: Clc1cccc(c1)N1/C(=N\C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK596704
Synonyms: 7-butyl-1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCn1c(CN2CCC(CC2)C)nc2c1c(=O)n(c(=O)n2C)C

STK596707
Synonyms: 2-ethyl-5-methyl-7-(4-methylpiperazin-1-yl)-3-phenylpyrazolo[1,5-a]pyrimidine
Smiles: CCc1nn2c(c1c1ccccc1)nc(cc2N1CCN(CC1)C)C

STK596710
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-[4-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCCCCOc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1noc(c1)C

STK596713
Synonyms: 5-{3-[(2-chlorobenzyl)oxy]phenyl}-N'-[(E)-(4-methoxyphenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1Cl

STK596714
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(2,3,4-trimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1c(OC)ccc(c1OC)C1N(c2nc3c(s2)cc(cc3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK596715
Synonyms: (4E)-2-(2,4-dichlorophenyl)-4-[4-(propan-2-yloxy)benzylidene]-4H-imidazol-5-ol
Smiles: CC(Oc1ccc(cc1)/C=C\1/N=C(N=C1O)c1ccc(cc1Cl)Cl)C

STK596717
Synonyms: 2-(4-chlorophenyl)-10-methyl-3-(2-phenylethyl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: Clc1ccc(cc1)c1nc2c(c(=O)n1CCc1ccccc1)c(=O)c1c(n2C)cccc1

STK596718
Synonyms: N'-{(E)-[1-(2-fluorobenzyl)-1H-indol-3-yl]methylidene}-2-hydroxybenzohydrazide
Smiles: O=C(c1ccccc1O)N/N=C/c1cn(c2c1cccc2)Cc1ccccc1F

STK596720
Synonyms: 2-cyclohexyl-3-cyclopentyl-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: O=c1n(C2CCCC2)c(nc2c1c(=O)c1ccccc1n2C)C1CCCCC1

STK596721
Synonyms: (5Z)-3-cyclohexyl-5-{1-[(4-fluorobenzyl)amino]propylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C/1\C(=NC(=O)N(C1=O)C1CCCCC1)O)/NCc1ccc(cc1)F

STK596723
Synonyms: 5,6-dimethyl-2-[(3-nitrobenzyl)amino][1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1nc2nc(nn2c(c1C)O)NCc1cccc(c1)[N+](=O)[O-]

STK596724
Synonyms: 2-ethyl-3-methyl-1-[(2E)-2-{[1-(propan-2-yl)-1H-indol-3-yl]methylidene}hydrazinyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1cn(c3c1cccc3)C(C)C)c1ccccc1n2

STK596725
Synonyms: N-[3-(4-bromophenyl)-6-chloro-4-oxo-4H-chromen-2-yl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1oc2ccc(cc2c(=O)c1c1ccc(cc1)Br)Cl

STK596728
Synonyms: 1-(2-bromophenyl)-2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: Clc1cccc(c1)c1nnc(n1C)SCC(=O)c1ccccc1Br

STK596729
Synonyms: 8-[(4-benzylpiperidin-1-yl)methyl]-7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1cccc(c1Cn1c(CN2CCC(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C)Cl

STK596732
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-{[4-(4-chlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)C

STK596733
Synonyms: (3a'S,6a'R)-5-fluoro-3'-(1-hydroxyethyl)-5'-(4-methoxybenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cc(F)cc2

STK596734
Synonyms: (5E)-6-hydroxy-3-(prop-2-en-1-yl)-5-(1-{[3-(trifluoromethyl)phenyl]amino}propylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\Nc2cccc(c2)C(F)(F)F)/CC)/C1=O)O

STK596735
Synonyms: N-[(2E)-3-benzyl-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(thiophen-2-yl)acetamide
Smiles: O=C(/N=C\1/SC2C(N1Cc1ccccc1)CS(=O)(=O)C2)Cc1cccs1

STK596737
Synonyms: 2-(6-chloro-1,3-benzothiazol-2-yl)-7-methyl-1-(thiophen-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1cccs1)c1sc2c(n1)ccc(c2)Cl

STK596738
Synonyms: N-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
Smiles: O=C(c1c2CCCc2nc2c1cccc2)NCC1CCCO1

STK596740
Synonyms: N-(4-chloro-2-methylphenyl)-2-{[4-(4-chlorophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)Cl)nnc1c1cccnc1

STK596741
Synonyms: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-1-(butan-2-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCC(N1C(=NC(=O)/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C1=O)S)C

STK596742
Synonyms: 2-chloro-N-[4-oxo-3-(thiophen-2-yl)-4H-thiochromen-2-yl]benzamide
Smiles: O=C(c1ccccc1Cl)Nc1sc2ccccc2c(=O)c1c1cccs1

STK596743
Synonyms: 8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl[(tert-butoxycarbonyl)amino](phenyl)acetate
Smiles: COc1ccc2c(c1)c(=O)oc1c2ccc(c1C)OC(=O)C(c1ccccc1)NC(=O)OC(C)(C)C

STK596744
Synonyms: 10-(3-hydroxyphenyl)-1,3,7,7-tetramethyl-5-phenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Oc1cccc(c1)C1OCC(n2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C)(C)C

STK596747
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(2,4-dichlorophenyl)ethylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(c(c1)Cl)/C(=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N)/C

STK596748
Synonyms: 2-{[4-ethyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1Cc1cccs1

STK596752
Synonyms: (6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)[2-(4-ethylphenyl)-4-methyl-1,3-thiazol-5-yl]methanone
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)c1sc(nc1C)c1ccc(cc1)CC

STK596753
Synonyms: 10-(2-fluorophenyl)-1,3-dimethyl-5-phenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Fc1ccccc1C1OCCn2c1c1c(c2c2ccccc2)c(=O)n(c(=O)n1C)C

STK596754
Synonyms: (4-{[(2'S,3S,3'S,10b'R)-2-oxo-3'-(thiophen-2-ylcarbonyl)-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2'-yl]carbonyl}phenoxy)acetonitrile
Smiles: N#CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccs2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK596755
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)OC)nnc1COc1ccccc1

STK596757
Synonyms: N-(butan-2-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CCC(NC(=O)c1nn2c(n1)c1c(nc2)sc2c1CCCC2)C

STK596760
Synonyms: 1-[10-(3,4-dimethoxyphenyl)-8-methyl-2-(thiophen-2-yl)-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: COc1cc(ccc1OC)C1C(=C(C)Oc2c1c1nc(nn1cn2)c1cccs1)C(=O)C

STK596762
Synonyms: 2-(6-chloro-1,3-benzothiazol-2-yl)-1-(furan-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccco1)c(=O)c1c(o2)cccc1

STK596763
Synonyms: 7-bromo-1-(4-fluorophenyl)-2-(4-methylpyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc(cc1)C1N(c2nccc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK596764
Synonyms: 8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)Cn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK596765
Synonyms: 9-tert-butyl-N-(2-hydroxypropyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CC(CNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CCC(C2)C(C)(C)C)O

STK596766
Synonyms: (3a'S,6a'R)-5'-(4-acetylphenyl)-3'-(1H-indol-3-ylmethyl)-5,7-dimethyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Cc1cc(C)c2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(cc1)C(=O)C)Cc1c[nH]c3c1cccc3)C(=O)N2

STK596767
Synonyms: 2-{[5-(5-methyl-1,2-oxazol-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-[(2E)-4-phenyl-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=c\1/scc([nH]1)c1ccccc1)CSc1nnc(o1)c1noc(c1)C

STK596768
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-methoxypropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Smiles: COCCCN1C(=O)c2c(C1=O)cc(cc2)C(=O)Nc1ccc2c(c1)OCCO2

STK596769
Synonyms: N-(3,4-dimethylphenyl)-N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccccc1)c1ccc(c(c1)C)C

STK596770
Synonyms: 7-phenyl-1-(pyridin-4-ylmethyl)-2-sulfanyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Sc1nc(=O)c2c(n1Cc1ccncc1)NC(=NC2(C(F)(F)F)C(F)(F)F)c1ccccc1

STK596771
Synonyms: 5-(4-tert-butylphenyl)-4-{[(E)-(4-hydroxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Oc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C

STK596772
Synonyms: 3-butyl-2-(2,4-dichlorophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: CCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccc(cc1Cl)Cl

STK596773
Synonyms: (5Z)-5-{[(2',6'-dihydroxy-4'-oxo-3-phenyl-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(N/C=C\3/C(=NC(=O)N(C3=O)C)O)ccc1N1C2CN(CC1)c1ccccc1

STK596774
Synonyms: (6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)[3-(trifluoromethyl)phenyl]methanone
Smiles: COc1cc2CCN(C(=C)c2cc1OC)C(=O)c1cccc(c1)C(F)(F)F

STK596775
Synonyms: methyl[1-(7-methyl-4-oxo-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-2-yl)-3-oxopiperazin-2-yl]acetate
Smiles: C=CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCNC(=O)C2CC(=O)OC)/C1=O

STK596776
Synonyms: methyl(7-hydroxy-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-yl)acetate
Smiles: COC(=O)Cc1cc(O)n2c(n1)c(c1ccccc1)c(n2)C

STK596777
Synonyms: 5-{3-[(2-chlorobenzyl)oxy]phenyl}-N'-[(E)-1H-indol-3-ylmethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1Cl)N/N=C/c1c[nH]c2c1cccc2

STK596778
Synonyms: 4-{[(E)-(2-bromophenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1ccccc1/C=N/n1c(=S)[nH]nc1c1ccccn1

STK596780
Synonyms: N-(2,4-dimethoxyphenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1ccc(cc1OC)OC

STK596781
Synonyms: ethyl4-[5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinolin-8-yl]piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C

STK596782
Synonyms: (5Z)-2-(4-bromophenyl)-5-(3,4-dimethoxybenzylidene)-3-(1,3-thiazol-2-yl)-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1cc(ccc1OC)/C=C/1\N=C(N(C1=O)c1nccs1)c1ccc(cc1)Br

STK596783
Synonyms: (6E)-4-(3-methyl-1-benzofuran-2-yl)-6-[(4-phenoxyphenyl)imino]-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: Nc1[nH]/c(=N\c2ccc(cc2)Oc2ccccc2)/nc(n1)c1oc2c(c1C)cccc2

STK596784
Synonyms: (2'S,3S,3'S,10b'R)-3'-(1,3-benzodioxol-5-ylcarbonyl)-2'-[(2-ethoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCOc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2ccc3c(c2)OCO3)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK596786
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2,4-dichlorophenyl)carbonyl]-2'-{[4-(propan-2-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CC(Oc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2Cl)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C

STK596788
Synonyms: 4-{[(E)-(5-bromo-2-methoxyphenyl)methylidene]amino}-5-(4-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cc(Br)ccc1OC

STK596791
Synonyms: (4E)-2-(4-chlorophenyl)-4-({[(1-ethylpyrrolidin-2-yl)methyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1)Cl

STK596792
Synonyms: 8-(3,4-dimethylphenyl)-1,7-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1ccc(cc1C)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK596793
Synonyms: 2-{[2-(3-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}ethanol
Smiles: OCCSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)OC

STK596794
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-3-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CC(CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2F)/C1=O)C

STK596795
Synonyms: 4-[(1E)-2-cyano-3-methoxy-3-oxoprop-1-en-1-yl]-2-methoxyphenyl2,4-dichlorobenzoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1ccc(cc1Cl)Cl)/C(=O)OC

STK596797
Synonyms: 4-methoxy-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)benzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)CC1CCCO1

STK596799
Synonyms: 4-hydroxy-1,7-dimethyl-8-[2-(morpholin-4-yl)ethyl]-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Oc1nc(=O)n(c2c1n1cc(n(c1n2)CCN1CCOCC1)C)C

STK596800
Synonyms: 1-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-2-ethyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1ccc(cc1)Cl)c1ccccc1n2

STK596802
Synonyms: 6-(4-chlorophenyl)-2-methyl-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1c(OC)cc(cc1OC)C1C2=C(O)CC(CC2=Nc2n1nc(n2)C)c1ccc(cc1)Cl

STK596803
Synonyms: 1-[4-(benzyloxy)-3-methoxyphenyl]-2-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(ccc1OCc1ccccc1)C1N(C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK596804
Synonyms: N-(3-chlorophenyl)-1-(4-ethylphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)Cl)cc3c1ccc(cc1)C

STK596805
Synonyms: 6,8-dibromo-2,4-dihydroxy-N-nonylquinoline-3-carboxamide
Smiles: CCCCCCCCCNC(=O)c1c(O)nc2c(c1O)cc(cc2Br)Br

STK596807
Synonyms: [2-(4-ethylphenyl)-4-methyl-1,3-thiazol-5-yl](7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)methanone
Smiles: CCc1ccc(cc1)c1nc(c(s1)C(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1)C

STK596809
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(4-methoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl

STK596810
Synonyms: 3-(3-chlorophenyl)-7-(3,5-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1cccc(c1)c1nnc2n1cnc1c2cnn1c1cc(C)cc(c1)C

STK596812
Synonyms: methylN-[(3,4-dimethylphenyl)carbamoyl]-D-phenylalaninate
Smiles: COC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccc(c(c1)C)C

STK596814
Synonyms: 3-amino-N-(2,2-diphenylethyl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)ccc(n2)c1cccs1)NCC(c1ccccc1)c1ccccc1

STK596815
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: C=CCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

STK596816
Synonyms: 2-chloro-3-[(E)-(1,3-dihydro-2H-benzimidazol-2-ylidenehydrazinylidene)methyl]-6-methoxyquinoline
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK596818
Synonyms: 6-cyclopentyl-1-phenyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(S)n(c2c1CN(CN2)C1CCCC1)c1ccccc1

STK596819
Synonyms: 4-{[(E)-(3-chlorophenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1cccc(c1)Cl

STK596820
Synonyms: 7,7-dimethyl-2-(4-methylphenyl)-4-{[2-(morpholin-4-yl)ethyl]sulfanyl}-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: Cc1ccc(cc1)c1nc(SCCN2CCOCC2)c2c(n1)CC(OC2)(C)C

STK596821
Synonyms: N-(2-ethyl-6-methylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccccc1)C

STK596822
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK596823
Synonyms: 9-(3,4-difluorophenyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Smiles: Fc1ccc(cc1F)N1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK596825
Synonyms: (3a'S,6a'R)-7-chloro-5'-cycloheptyl-5-methyl-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C1CCCCCC1)C(=O)Nc1c2cc(C)cc1Cl

STK596826
Synonyms: 3-(4-tert-butylphenyl)-5-[(3-chlorobenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
Smiles: Clc1cccc(c1)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C

STK596827
Synonyms: 2-(2,4-dichlorophenoxy)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Smiles: COc1cc2c(cc1OC)CCn1c2cc(Oc2ccc(cc2Cl)Cl)nc1=O

STK596828
Synonyms: 2-(4-methoxyphenyl)-N-[(2E)-3-(3-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: COc1ccc(cc1)CC(=O)/N=C\1/SC2C(N1c1cccc(c1)OC)CS(=O)(=O)C2

STK596829
Synonyms: 4-methyl-2-[2,6,8-trioxo-10-(pyridin-3-yl)-3,4a,5,5a,6,8,8a,9,9a,10-decahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindol-7(2H)-yl]pentanoicacid
Smiles: CC(CC(N1C(=O)C2C(C1=O)C1CC2C2C1Sc1c(C2c2cccnc2)sc(=O)[nH]1)C(=O)O)C

STK596832
Synonyms: N-(4-chlorophenyl)-2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Cl)nnc1c1cccc(c1)C

STK596833
Synonyms: N-[(2Z)-5-({2-[(4-methylbenzyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylpropanamide
Smiles: O=C(NCc1ccc(cc1)C)CSc1n[nH]/c(=N/C(=O)CCc2ccccc2)/s1

STK596834
Synonyms: 6-amino-1-(4-chlorophenyl)-4-(3,4-dihydroxyphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(c(c1)O)O)c(C)nn2c1ccc(cc1)Cl

STK596836
Synonyms: (E)-{2-(2,3-dimethoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[3-fluoro-4-(propan-2-yloxy)phenyl]methanolate
Smiles: COc1cccc(c1OC)C1/C(=C(/c2ccc(c(c2)F)OC(C)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

STK596837
Synonyms: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chloro-2-methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1C)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK596838
Synonyms: 5-(4-tert-butylphenyl)-4-{[(E)-(4-chlorophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C

STK596840
Synonyms: (5Z)-3-butyl-5-{[(3-ethyl-2',6'-dihydroxy-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCCCN1C(=O)N=C(/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)CC)C(=NC(=NC2=O)O)O)/C1=O)O

STK596842
Synonyms: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: CC(c1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C)C

STK596846
Synonyms: (E)-[3-fluoro-4-(propan-2-yloxy)phenyl]{2-(2-methoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1ccccc1C1/C(=C(/c2ccc(c(c2)F)OC(C)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

STK596847
Synonyms: N-(4-butylphenyl)-2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccco1

STK596848
Synonyms: N-[(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]glycyl-D-isoleucyl-S-benzyl-D-cysteine
Smiles: CC[C@@H]([C@H](C(=O)N[C@@H](C(=O)O)CSCc1ccccc1)NC(=O)CNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C)C

STK596849
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-(2,4-dichlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(c(c1)Cl)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)c1ccccc1

STK596851
Synonyms: N-(1,3-benzodioxol-5-yl)-2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1c1cccc(c1)Cl

STK596852
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-methylphenyl)carbonyl]-2'-[(4-propoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK596853
Synonyms: ethyl5-methoxy-3-{[(4-methoxyphenyl)sulfonyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NS(=O)(=O)c1ccc(cc1)OC)cc(cc2)OC

STK596854
Synonyms: 7-bromo-1-(2-methoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccccc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK596855
Synonyms: N'-[(1E)-1-(1-benzyl-2-hydroxy-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene)propyl]-2-chlorobenzohydrazide
Smiles: CC/C(=C\1/C(=O)N=C(N(C1=O)Cc1ccccc1)O)/NNC(=O)c1ccccc1Cl

STK596857
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chlorophenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)Cl)nnc1COc1ccc(cc1)Cl

STK596858
Synonyms: N-[(2Z)-3-(2,5-dimethylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: Cc1ccc(c(c1)N1/C(=N/C(=O)C)/SC2C1CS(=O)(=O)C2)C

STK596863
Synonyms: 2-(2-methoxyphenyl)-10-methyl-8-phenyl-11-(pyridin-3-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1c1nn2c(n1)c1c(nc2)Oc2c(C1c1cccnc1)c(C)nn2c1ccccc1

STK596864
Synonyms: N-(1-imino-1,3-dihydro-2H-isoindol-2-yl)naphthalene-1-carboxamide
Smiles: N=C1N(Cc2c1cccc2)NC(=O)c1cccc2c1cccc2

STK596867
Synonyms: 4-{(2E)-2-[(6-methoxy-1H-indol-3-yl)methylidene]hydrazinyl}benzoicacid
Smiles: COc1ccc2c(c1)[nH]cc2/C=N/Nc1ccc(cc1)C(=O)O

STK596868
Synonyms: N-(2-methoxyethyl)-5-methyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: COCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2

STK596870
Synonyms: N-[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]-4-oxo-1-phenyl-1,4-dihydropyridazine-3-carboxamide
Smiles: O=c1ccn(nc1C(=O)/N=c/1\sc2c([nH]1)ccc(c2)S(=O)(=O)C)c1ccccc1

STK596871
Synonyms: 14-[4-(difluoromethoxy)-3-methoxyphenyl]-3,3-dimethyl-2,3,4,6,7,14-hexahydro-1H-[1,3]dioxolo[6,7]isoquino[2,1-a]quinolin-1-one
Smiles: COc1cc(ccc1OC(F)F)C1C=C2N(C3=C1C(=O)CC(C3)(C)C)CCc1c2cc2OCOc2c1

STK596872
Synonyms: ethyl4,5-dimethyl-2-[(pyrrolidin-1-ylacetyl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CN2CCCC2)sc(c1C)C

STK596873
Synonyms: (5S)-3-(4-phenoxyphenyl)-5-(propan-2-yl)imidazolidine-2,4-dione
Smiles: CC([C@@H]1NC(=O)N(C1=O)c1ccc(cc1)Oc1ccccc1)C

STK596874
Synonyms: (5E)-5-{1-[(2,5-dimethoxyphenyl)amino]propylidene}-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(c(c1)N/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/CC)OC

STK596875
Synonyms: 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-(3-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(c(c1)Cl)c1cn2c(n1c1cccc(c1)C)nc1c2c(=O)n(C)c(=O)n1C

STK596879
Synonyms: 1-(2-{[(2E)-6-ethoxy-1,3-benzothiazol-2(3H)-ylidene]amino}-2-oxoethyl)piperidine-4-carboxamide
Smiles: CCOc1ccc2c(c1)s/c(=N/C(=O)CN1CCC(CC1)C(=O)N)/[nH]2

STK596884
Synonyms: 8-(2-methoxy-5-methylphenyl)-1,6,7-trimethyl-3-(2-methylprop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CC(=C)C)C

STK596886
Synonyms: 6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-8-[(2-hydroxypropyl)amino]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(NCC(O)C)nc2c1c(O)nc(=O)n2C)COc1ccc(cc1)C

STK596887
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(3-fluoro-4-methoxyphenyl)carbonyl]-3'-[(4-methylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1F)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK596889
Synonyms: 8-[(4-ethylpiperazin-1-yl)methyl]-7-(3-hydroxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCCn1c(CN2CCN(CC2)CC)nc2c1c(=O)n(c(=O)n2C)C

STK596890
Synonyms: 3-(1H-benzimidazol-2-yl)-1-[3-(diethylamino)propyl]-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: CCN(CCCn1c2nc3ccccc3nc2c(c1N)c1nc2c([nH]1)cccc2)CC

STK596891
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2,4-dichlorophenyl)carbonyl]-2'-{[4-(prop-2-en-1-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: C=CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2Cl)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK596893
Synonyms: 1-(4-methoxyphenyl)-5-oxo-N-{(2S)-1-oxo-1-[(tetrahydrofuran-2-ylmethyl)amino]propan-2-yl}pyrrolidine-3-carboxamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)NCC1CCCO1)C

STK596894
Synonyms: 4-[(4-chlorobenzyl)oxy]-N-[(4Z)-2-(4-methylphenyl)quinazolin-4(3H)-ylidene]aniline
Smiles: Cc1ccc(cc1)c1[nH]/c(=N\c2ccc(cc2)OCc2ccc(cc2)Cl)/c2c(n1)cccc2

STK596895
Synonyms: 7-bromo-1-(2,5-dimethoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br)OC

STK596896
Synonyms: 7-chloro-3'-[2-(3,4-dimethoxyphenyl)ethyl]-6'-hydroxy-3-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: COc1ccc(cc1OC)CCN1C(=O)N=C(C2(C1=O)Cc1c(Cl)cccc1N1C2CN(C)CC1)O

STK596897
Synonyms: 5-(4-chlorophenyl)-10-(4-hydroxy-3,5-dimethoxyphenyl)-1,3-dimethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: COc1cc(cc(c1O)OC)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccc(cc1)Cl)C

STK596898
Synonyms: N-[5-hydroxy-2-(2-phenylethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-2-phenylbutanamide
Smiles: CCC(C(=O)Nc1cc(O)nc2n1nc(n2)CCc1ccccc1)c1ccccc1

STK596899
Synonyms: 4-(4-chlorophenyl)-2-phenyl-4,6,7,8-tetrahydro-2H-pyrazolo[3,4-b]quinoline-3,5-diol
Smiles: Clc1ccc(cc1)C1C2=C(O)CCCC2=Nc2c1c(O)n(n2)c1ccccc1

STK596901
Synonyms: (3a'S,6a'R)-5'-cyclopentyl-3'-(3,4-dihydroxybenzyl)-6,7-dimethyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: O=C1N(C2CCCC2)C(=O)[C@@H]2[C@H]1C(Cc1ccc(c(c1)O)O)NC12C(=O)Nc2c1ccc(c2C)C

STK596904
Synonyms: 2-hydroxy-4-{(Z)-[4-iminio-8-(methylsulfonyl)-2-oxo-2H-pyrimido[2,1-b][1,3]benzothiazol-3(4H)-ylidene]methyl}phenolate
Smiles: O=C1N=c2sc3c(n2C(=[NH2+])/C/1=C/c1ccc(c(c1)O)[O-])ccc(c3)S(=O)(=O)C

STK596905
Synonyms: N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-2-(3-hydroxy-5-methyl-4H-pyrazol-4-yl)acetohydrazide
Smiles: O=C(CC1C(=NN=C1O)C)N/N=C/c1ccc(cc1O)O

STK596907
Synonyms: 1-[11-(4-ethoxyphenyl)-1-hydroxy-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2,2,2-trifluoroethanone
Smiles: CCOc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(F)(F)F)cccc2)(C)C

STK596908
Synonyms: 7'-[(E)-(1-cyclopropyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/c1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)C1CC1

STK596909
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-[4-(propan-2-yl)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)C(C)C)c(=O)c1c(o2)cccc1

STK596910
Synonyms: 9-(4-chlorophenyl)-6-(4-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccc(cc2)Cl)ncn3)C1)O

STK596911
Synonyms: 2'-hydroxy-13-methyl-1'-(2-methylpropyl)-1,2,3,4,5,5a-hexahydro-4'H,7H,8H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2-a]azepine-6,5'-pyrimidine]-4',6',8(1'H)-trione
Smiles: CC(CN1C(=NC(=O)C2(C1=O)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C)O)C

STK596912
Synonyms: methylN-{[4-(propan-2-yl)phenyl]carbamoyl}-L-methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)Nc1ccc(cc1)C(C)C

STK596913
Synonyms: 6,7-dimethoxy-N-methyl-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Smiles: CNC(=S)N1CCc2c(C1)cc(c(c2)OC)OC

STK596918
Synonyms: 1-[4-(benzyloxy)phenyl]-7-fluoro-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)OCc1ccccc1)c1noc(c1)C

STK596919
Synonyms: 2-amino-6-hydroxy-5-[4-(methylsulfanyl)phenyl]-3,5-dihydro-4H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CSc1ccc(cc1)C1C2=C(O)c3c(C2=Nc2c1c(=O)[nH]c(n2)N)cccc3

STK596920
Synonyms: 6-hydroxy-8-[4-(2-hydroxyethyl)piperazin-1-yl]-7-[2-hydroxy-3-(naphthalen-2-yloxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OCCN1CCN(CC1)c1nc2c(n1CC(COc1ccc3c(c1)cccc3)O)c(O)nc(=O)n2C

STK596922
Synonyms: N-(1,3-benzodioxol-5-yl)-2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)nc2c(c1=O)c1CCCCc1s2

STK596924
Synonyms: 2-(4-bromo-3-nitrophenyl)-4-imino-6,7,11,12-tetrahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc2OCCCOc2c1)c1ccc(c(c1)[N+](=O)[O-])Br

STK596925
Synonyms: (2Z)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-N-phenylethanethioamide
Smiles: S=C(/C=C/1\NCCc2c1cc1OCOc1c2)Nc1ccccc1

STK596926
Synonyms: 2-(8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1CC(=O)N)c(=O)n(c(=O)n2C)C

STK596927
Synonyms: 4-tert-butyl-N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]benzamide
Smiles: COc1ccc(cc1OC)c1nonc1NC(=O)c1ccc(cc1)C(C)(C)C

STK596929
Synonyms: 3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[4-(propan-2-yl)phenyl]propanamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CCn1nnc2c(c1=O)cccc2

STK596930
Synonyms: N-[3-(3-chlorophenyl)-4-oxo-4H-chromen-2-yl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1oc2ccccc2c(=O)c1c1cccc(c1)Cl

STK596931
Synonyms: 3-(1-butyl-1H-indol-3-yl)-1-(naphthalen-1-yl)pyrrolidine-2,5-dione
Smiles: CCCCn1cc(c2c1cccc2)C1CC(=O)N(C1=O)c1cccc2c1cccc2

STK596932
Synonyms: (3a'S,6a'R)-5-chloro-5'-(4-fluorobenzyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cc(Cl)cc2

STK596933
Synonyms: 2,2,5-trimethyl-N-(pyridin-2-ylmethyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCc1ccccn1

STK596934
Synonyms: 2-{[3-cyano-5-hydroxy-4-(4-methylphenyl)-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C)N=C2C(=C(O)CCC2)C1c1ccc(cc1)C

STK596935
Synonyms: 3-[(Z)-(3-cyclopentyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(2-fluorophenyl)piperazin-1-yl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2F)/C(=O)N1C1CCCC1

STK596936
Synonyms: (4Z)-2-(4-chlorophenyl)-4-[2-(3,4,5-trimethoxyphenyl)-4H-chromen-4-ylidene]-1,3-oxazol-5(4H)-one
Smiles: COc1cc(cc(c1OC)OC)C1=C/C(=C\2/N=C(OC2=O)c2ccc(cc2)Cl)/c2c(O1)cccc2

STK596937
Synonyms: 4-(2,6,8-trioxo-10-phenyl-3,4a,5,5a,6,8,8a,9,9a,10-decahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindol-7(2H)-yl)butanoicacid
Smiles: OC(=O)CCCN1C(=O)C2C(C1=O)C1CC2C2C1Sc1c(C2c2ccccc2)sc(=O)[nH]1

STK596938
Synonyms: 5,7-dichloro-1-(2,3-dimethoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cccc(c1OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c(Cl)cc(c1)Cl

STK596939
Synonyms: 4-[(4-chlorophenyl)carbonyl]-2-[3-(trifluoromethyl)phenyl]hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione
Smiles: Clc1ccc(cc1)C(=O)C1N2CCCC2C2C1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F

STK596940
Synonyms: 2-{(2E)-[(1-phenyl-1H-pyrrol-2-yl)methylidene]hydrazinylidene}-2,3-dihydro-1H-benzimidazole
Smiles: c1ccc(cc1)n1cccc1/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK596941
Synonyms: 2-(4-benzylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-ol
Smiles: Oc1nc(nc2c1CCC2)N1CCN(CC1)Cc1ccccc1

STK596942
Synonyms: 7-(4-ethylpiperazin-1-yl)-3-(2-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidine
Smiles: CCN1CCN(CC1)c1cc(C)nc2n1nc(c2c1ccccc1OC)C

STK596945
Synonyms: 4-(2-nitrophenyl)-4,10-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: NC1=NC(n2c(=N1)[nH]c1c2cccc1)c1ccccc1[N+](=O)[O-]

STK596946
Synonyms: (5E)-5-(1-{[3-(dimethylamino)propyl]amino}propylidene)-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/NCCCN(C)C

STK596947
Synonyms: N-(3,4-dimethoxyphenyl)-2-{[5-(2-fluorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)OC)OC)nnc1c1ccccc1F

STK596949
Synonyms: (10aS)-2-(2-nitrophenyl)-10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione
Smiles: O=C1N2Cc3ccccc3C[C@H]2C(=O)N1c1ccccc1[N+](=O)[O-]

STK596950
Synonyms: 7-chloro-1-(3-chlorophenyl)-2-(2-hydroxy-2-phenylethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1cccc(c1)C1N(CC(c2ccccc2)O)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK596951
Synonyms: 6-chloro-2-oxo-4-propyl-2H-chromen-7-ylN-(tert-butoxycarbonyl)-beta-alaninate
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)CCNC(=O)OC(C)(C)C

STK596952
Synonyms: (5Z)-5-{[(3-benzyl-2',6'-dihydroxy-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(N/C=C\3/C(=NC(=O)N(C3=O)C)O)ccc1N1C2CN(CC1)Cc1ccccc1

STK596953
Synonyms: 4-imino-2-(thiophen-2-yl)-6,7,11,12-tetrahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc2OCCCOc2c1)c1cccs1

STK596955
Synonyms: (E)-{2-(3-bromophenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}[3-fluoro-4-(propan-2-yloxy)phenyl]methanolate
Smiles: C[NH+](CCCN1C(c2cccc(c2)Br)/C(=C(/c2ccc(c(c2)F)OC(C)C)\[O-])/C(=O)C1=O)C

STK596956
Synonyms: N-(4-bromophenyl)-2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK596957
Synonyms: 2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2cccc(c2)F)nnc1c1cccc(c1)Cl

STK596958
Synonyms: 8-(2-methoxyphenyl)-1,6,7-trimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccccc1n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCCCC1

STK596959
Synonyms: 8-(4-ethoxyphenyl)-3-(4-fluorobenzyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)F

STK596960
Synonyms: tert-butyl(3S)-3-({2-[(4-methoxyphenyl)amino]-2-oxoethyl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: COc1ccc(cc1)NC(=O)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK596962
Synonyms: N-(3,4-dimethylphenyl)-2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)C)C)nnc1Cc1cccs1

STK596963
Synonyms: N-[4-(3-methoxyphenyl)-6-methyl-2-(4-methylphenyl)-5-oxo-2,5-dihydropyridazin-3-yl]cyclohexanecarboxamide
Smiles: COc1cccc(c1)c1c(=O)c(C)nn(c1NC(=O)C1CCCCC1)c1ccc(cc1)C

STK596964
Synonyms: tert-butyl(3S)-3-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: COc1cc(CCNC(=O)[C@@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)ccc1OC

STK596965
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(2,5-dimethoxyphenyl)carbonyl]-3'-[(4-methylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)OC

STK596966
Synonyms: 7-(3,4-dichlorobenzyl)-1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCCCN1Cc1nc2c(n1Cc1ccc(c(c1)Cl)Cl)c(=O)n(c(=O)n2C)C

STK596967
Synonyms: N-(3-bromophenyl)-2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Br)nnc1c1cccc(c1)Cl

STK596969
Synonyms: 1-(3-bromophenyl)-2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: C=CCn1c(SCC(=O)c2cccc(c2)Br)nnc1Cc1cccs1

STK596970
Synonyms: 3-[6-(morpholin-4-yl)-6-oxohexyl]quinazolin-4(3H)-one
Smiles: O=C(N1CCOCC1)CCCCCn1cnc2c(c1=O)cccc2

STK596972
Synonyms: N-(3-bromophenyl)-2-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: CCC(n1cnc2c(c1=O)cccc2)C(=O)Nc1cccc(c1)Br

STK596973
Synonyms: 3-benzyl-10-methyl-2-phenylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: O=c1n(Cc2ccccc2)c(nc2c1c(=O)c1ccccc1n2C)c1ccccc1

STK596974
Synonyms: N-[4-(diethylamino)phenyl]-2-{[4-ethyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1CC)COc1ccccc1)CC

STK596975
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: Oc1cccc(c1)C1N(c2nnc(s2)SCc2ccccc2F)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK596976
Synonyms: N'-[(E)-(2-hydroxyphenyl)methylidene]-4,6-dimethoxy-1H-indole-2-carbohydrazide
Smiles: COc1cc(OC)cc2c1cc([nH]2)C(=O)N/N=C/c1ccccc1O

STK596977
Synonyms: (2E)-N-[(2E)-5-({2-[(2,6-diethylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylprop-2-enamide
Smiles: CCc1cccc(c1NC(=O)CSc1n[nH]/c(=N\C(=O)/C=C/c2ccccc2)/s1)CC

STK596980
Synonyms: N'-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylidene]pyridine-4-carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccc2c(c1)OCCO2

STK596982
Synonyms: 2-{[4-amino-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(butan-2-yl)phenyl]acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1[nH]nc2c1CCC2)C

STK596983
Synonyms: (5E)-6-hydroxy-5-(1-{[2-(1H-indol-3-yl)ethyl]amino}ethylidene)-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C(\NCCc2c[nH]c3c2cccc3)/C)/C1=O)O

STK596984
Synonyms: (2E)-3-[2-(azepan-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-cyclohexylprop-2-enamide
Smiles: N#C/C(=C\c1c(nc2n(c1=O)cccc2C)N1CCCCCC1)/C(=O)NC1CCCCC1

STK596985
Synonyms: (3R)-N-(4-methoxybenzyl)-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1

STK596986
Synonyms: (1'S,3R,3'S,7a'S)-7''-chloro-1'-{[3-(prop-2-en-1-yloxy)phenyl]carbonyl}-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: C=CCOc1cccc(c1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1Cl

STK596987
Synonyms: 4-{[(E)-anthracen-9-ylmethylidene]amino}-5-(4-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1c2ccccc2cc2c1cccc2

STK596988
Synonyms: 1-(4-ethoxyphenyl)-N-(3-methoxyphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)OC)n2c3c1CCCCn3c(c2)c1ccccc1

STK596989
Synonyms: 3-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CC(CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2)/C1=O)C

STK596990
Synonyms: 3-(2,4-difluorophenyl)-10-methyl-6-propyl-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: CCCc1cc(=O)oc2c1cc1CN(COc1c2C)c1ccc(cc1F)F

STK596994
Synonyms: 4-({[5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Smiles: C=CCn1c(SCc2ccc(cc2)C#N)nnc1c1ccc(cc1)F

STK596995
Synonyms: 2-(8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Smiles: NC(=O)Cn1c(CN2CCN(CC2)c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C

STK596998
Synonyms: (3a'S,6a'R)-3'-benzyl-5-fluoro-5'-(2-methoxyethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccccc2)C(=O)Nc2c1cc(F)cc2

STK597001
Synonyms: methylN-(cyclopropylcarbamoyl)-D-methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)NC1CC1

STK597005
Synonyms: N'-[(E)-(2-chloro-6-methoxyquinolin-3-yl)methylidene]-2-hydroxybenzohydrazide
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)/C=N/NC(=O)c1ccccc1O

STK597006
Synonyms: 5-cyclopropyl-N'-[(E)-naphthalen-1-ylmethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)C1CC1)N/N=C/c1cccc2c1cccc2

STK597007
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-bromo-3-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)C)Br)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK597009
Synonyms: (2Z)-1-(2,6-dichloropyridin-4-yl)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)ethanone
Smiles: Clc1nc(Cl)cc(c1)C(=O)/C=C/1\NCCc2c1cc1OCOc1c2

STK597012
Synonyms: 1-(4-methoxyphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccccn1

STK597013
Synonyms: 9,10-dimethoxy-2-[4-(2-methylbutan-2-yl)phenoxy]-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Smiles: CCC(c1ccc(cc1)Oc1nc(=O)n2c(c1)c1cc(OC)c(cc1CC2)OC)(C)C

STK597014
Synonyms: methyl3-{[(2,4-dimethylphenyl)sulfonyl]amino}-5-fluoro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NS(=O)(=O)c1ccc(cc1C)C)cc(cc2)F

STK597015
Synonyms: N-(2-ethylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK597017
Synonyms: 2-(9-methoxy-5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)-N-(3-phenylpropyl)acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2CC(=O)NCCCc1ccccc1

STK597018
Synonyms: 7-chloro-3-ethyl-1',3'-dipropyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCCN1C(=O)N(CCC)C(=O)C2(C1=O)Cc1c(Cl)cccc1N1C2CN(CC)CC1

STK597019
Synonyms: 2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(dimethylamino)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1ccc(cc1)C(C)(C)C

STK597020
Synonyms: N-(4-{[(Z)-(4-hydroxy-2,6-dioxo-1-phenyl-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)N/C=C\1/C(=NC(=O)N(C1=O)c1ccccc1)O

STK597026
Synonyms: 4-(4-chlorophenyl)-N,1-bis(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccc(cc1)C)cc3c1ccc(cc1)Cl

STK597027
Synonyms: 2-methyl-N-{1-methyl-4-oxo-3-[3-(trifluoromethyl)phenyl]-1,4-dihydroquinolin-2-yl}benzamide
Smiles: O=C(c1ccccc1C)Nc1n(C)c2ccccc2c(=O)c1c1cccc(c1)C(F)(F)F

STK597029
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C)nnc1COc1ccc(cc1)Cl

STK597030
Synonyms: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-3-(2-fluorophenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Fc1ccccc1N1C(=S)S/C(=C\c2nc3c([nH]2)cccc3)/C1=O

STK597031
Synonyms: methyl2-[1,7-dimethyl-2,4-dioxo-8-(2-phenylethyl)-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]propanoate
Smiles: COC(=O)C(n1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)CCc1ccccc1)C)C

STK597032
Synonyms: (4-chlorophenyl)(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)c1ccc(cc1)Cl

STK597033
Synonyms: (10aS)-2-(2-fluorophenyl)-10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione
Smiles: O=C1N(C(=O)[C@H]2N1Cc1ccccc1C2)c1ccccc1F

STK597034
Synonyms: 2-(2-chlorophenyl)-10-methyl-3-(2-methylpropyl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CC(Cn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccccc1Cl)C

STK597035
Synonyms: N-[1-(1H-benzimidazol-2-yl)-3-methyl-1H-pyrazol-5-yl]-2,3-dimethylbenzamide
Smiles: Cc1nn(c(c1)NC(=O)c1cccc(c1C)C)c1nc2c([nH]1)cccc2

STK597036
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1COc1ccc(cc1)C

STK597038
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK597039
Synonyms: 3-[(4-chlorophenoxy)methyl]-4-ethyl-5-[(2-fluorobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: CCn1c(nnc1SCc1ccccc1F)COc1ccc(cc1)Cl

STK597040
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(4-nitrophenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/[O-])/C1c1ccccc1)CC

STK597042
Synonyms: 3-[2-(4-fluorophenyl)ethyl]-7-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Fc1ccc(cc1)CCn1cnc2c(c1=O)[nH]c1c2ccc(c1)C

STK597043
Synonyms: 2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK597047
Synonyms: 5-[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-3-(4-chlorophenyl)-2,6-dihydroxypyrimidin-4(3H)-one
Smiles: Clc1ccc(cc1)n1c(O)nc(c(c1=O)C(=O)/C=C/c1ccc2c(c1)OCO2)O

STK597048
Synonyms: 3-methyl-N-(morpholin-4-yl)-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Smiles: Cn1c(=O)oc2c1ccc(c2)S(=O)(=O)NN1CCOCC1

STK597049
Synonyms: N-[4-(butan-2-yl)phenyl]-2-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)OC)C

STK597051
Synonyms: 1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCCCN1Cc1nc2c(n1Cc1cccc3c1cccc3)c(=O)n(c(=O)n2C)C

STK597052
Synonyms: 1-(4-chlorophenyl)-6-cyclopentyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Clc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)C1CCCC1

STK597054
Synonyms: 7-chloro-2-(2-phenylethyl)-1-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccn1)CCc1ccccc1

STK597055
Synonyms: 2-[(3-hydroxypropyl)amino]-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: OCCCNc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCCC3

STK597056
Synonyms: ethyl4-[({[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK597057
Synonyms: 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-(4-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1ccc(cc1)n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1Cl)Cl

STK597059
Synonyms: 3-(5-{(E)-[4-iminio-8-(methylsulfonyl)-2-oxo-2H-pyrimido[2,1-b][1,3]benzothiazol-3(4H)-ylidene]methyl}furan-2-yl)benzoate
Smiles: O=C1N=c2sc3c(n2C(=[NH2+])/C/1=C\c1ccc(o1)c1cccc(c1)C(=O)[O-])ccc(c3)S(=O)(=O)C

STK597060
Synonyms: 6-butyl-2-hydroxy-1-(4-methylphenyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCCCN1CNc2c(C1)c(=O)nc(n2c1ccc(cc1)C)O

STK597062
Synonyms: (2Z)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-[4-(naphthalen-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/c1cc(OC)c(c(c1)[N+](=O)[O-])O)/c1scc(n1)c1ccc2c(c1)cccc2

STK597064
Synonyms: 2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(tetrahydrofuran-2-ylmethyl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)F)NCC1CCCO1

STK597065
Synonyms: 6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-ylN-(tert-butoxycarbonyl)-D-methioninate
Smiles: CSCC[C@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl)NC(=O)OC(C)(C)C

STK597070
Synonyms: 9-(4-methylphenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Cc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1

STK597071
Synonyms: (3Z)-1-heptyl-3-(4-hydroxy-2-oxo-1,3-thiazol-5(2H)-ylidene)-1,3-dihydro-2H-indol-2-one
Smiles: CCCCCCCN1c2ccccc2/C(=C\2/SC(=O)N=C2O)/C1=O

STK597072
Synonyms: N-(2,4-dimethoxyphenyl)-2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2OC)OC)nnc1COc1ccc(cc1)C

STK597073
Synonyms: 6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-pentylhexanamide
Smiles: CCCCCNC(=O)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK597074
Synonyms: (1S)-1-{5-[(2,6-dichlorobenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}-3-(methylsulfanyl)propan-1-amine
Smiles: CSCC[C@@H](c1nnc(o1)SCc1c(Cl)cccc1Cl)N

STK597077
Synonyms: 2-[4-(2-ethoxyphenoxy)quinazolin-2-yl]-6-methoxyphenol
Smiles: CCOc1ccccc1Oc1nc(nc2c1cccc2)c1cccc(c1O)OC

STK597078
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(2,4-dimethoxyphenyl)carbonyl]-3'-(phenylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)OC)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK597079
Synonyms: N,N-dimethyl-N'-(2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)propane-1,3-diamine
Smiles: CN(CCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C)C

STK597080
Synonyms: 7-chloro-1-(2,4-dimethoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(c(c1)OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK597081
Synonyms: 4-chloro-N-[4-chloro-3-(propanoylamino)phenyl]benzamide
Smiles: CCC(=O)Nc1cc(ccc1Cl)NC(=O)c1ccc(cc1)Cl

STK597083
Synonyms: 1,3-dimethyl-5,10-diphenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: O=c1n(C)c(=O)c2c(n1C)c1C(OCCn1c2c1ccccc1)c1ccccc1

STK597087
Synonyms: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/c1ccc2c(c1)CCCN2Cc1ccccc1)c1ccccc1C

STK597088
Synonyms: (4E)-5-(2,4-dimethoxyphenyl)-4-[hydroxy(4-nitrophenyl)methylidene]-1-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(c(c1)OC)C1/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C(=O)N1c1ccc(cc1)OC

STK597089
Synonyms: (4E)-4-[furan-2-yl(hydroxy)methylidene]-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccc(cc1)OC

STK597090
Synonyms: 8-(1H-benzimidazol-2-ylsulfanyl)-7-(2-chlorobenzyl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Clc1ccccc1Cn1c(Sc2nc3c([nH]2)cccc3)nc2c1c(O)nc(=O)n2C

STK597092
Synonyms: (3E)-3-(4-fluorobenzylidene)-4-imino-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one
Smiles: Fc1ccc(cc1)/C=C\1/C(=O)N=c2n(C1=N)c1ccccc1s2

STK597093
Synonyms: dimethyl[3-(piperidin-1-yl)quinoxalin-2-yl]propanedioate
Smiles: COC(=O)C(c1nc2ccccc2nc1N1CCCCC1)C(=O)OC

STK597096
Synonyms: N-{(1Z)-1-[1-cyano-2-(cyclopentylamino)-2-oxoethylidene]-1H-isoindol-3-yl}-2-fluorobenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1F)/C(=O)NC1CCCC1

STK597098
Synonyms: N-(3-bromophenyl)-2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Br)nnc1c1cccc(c1)Cl

STK597100
Synonyms: 6,7-dimethyl-2-(5-methyl-1,2-oxazol-3-yl)-1-(3-propoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCCOc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)C)C

STK597101
Synonyms: 6'-hydroxy-2,4-dimethyl-8-nitro-3'-(2,4,6-trimethylphenyl)-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1c(C)cc(cc1C)C)O)[N+](=O)[O-]

STK597102
Synonyms: (4E)-2-(3,4-dimethylphenyl)-4-{[(5-methylpyridin-2-yl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: Cc1ccc(nc1)N/C=C\1/C(=O)N(c2ccc(c(c2)C)C)C(=O)c2c1cccc2

STK597103
Synonyms: 6-(5-bromo-2-methoxyphenyl)-10-(methylsulfanyl)-7-(thiophen-2-yl)-7,11-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1C1Oc2ccccc2C2=C1C(c1cccs1)n1c(=N2)[nH]c(n1)SC)Br

STK597104
Synonyms: N-cyclohexyl-2-{[10-ethyl-10-methyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n2c1nnc2SCC(=O)NC1CCCCC1)SC

STK597106
Synonyms: N-(furan-2-ylmethyl)-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccccc1)Cc1ccco1

STK597107
Synonyms: (10aS)-2-(3-fluorophenyl)-10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione
Smiles: Fc1cccc(c1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK597108
Synonyms: N-[4-(4-ethyl-2-oxo-2H,8H-chromeno[8,7-e][1,3]oxazin-9(10H)-yl)phenyl]acetamide
Smiles: CCc1cc(=O)oc2c1ccc1c2CN(CO1)c1ccc(cc1)NC(=O)C

STK597109
Synonyms: 1'-ethyl-2'-methyl-6'-nitro-1,3-diphenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione
Smiles: CCN1c2ccc(cc2CC2(C1C)C(=O)N(c1ccccc1)C(=S)N(C2=O)c1ccccc1)[N+](=O)[O-]

STK597110
Synonyms: 3-amino-N-(2,6-dichlorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide
Smiles: Clc1cccc(c1NC(=O)c1sc2c(c1N)cc1c(n2)CCCCC1)Cl

STK597112
Synonyms: N-[4-(butan-2-yl)phenyl]-2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl)C

STK597113
Synonyms: 2-{[5-(2-fluorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccccc1F

STK597114
Synonyms: (4E)-4-[hydroxy(thiophen-2-yl)methylidene]-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-phenylpyrrolidine-2,3-dione
Smiles: CSc1nnc(s1)N1C(c2ccccc2)/C(=C(/c2cccs2)\O)/C(=O)C1=O

STK597116
Synonyms: 1-(4-hydroxy-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimidin-2-yl)-3-(2-methylphenyl)guanidine
Smiles: N=C(Nc1ccccc1C)Nc1nc(CSc2nnc(s2)C)cc(n1)O

STK597117
Synonyms: 2-(6-methyl-1,3-benzothiazol-2-yl)-1-[4-(prop-2-en-1-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: C=CCOc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK597118
Synonyms: 4-{[(E)-(5-bromo-2-fluorophenyl)methylidene]amino}-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1ccc(c(c1)/C=N/n1c(COc2ccccc2)n[nH]c1=S)F

STK597122
Synonyms: 2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK597124
Synonyms: 1-(3-ethoxy-4-hydroxyphenyl)-2-(6-methoxy-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cc(ccc1O)C1N(c2nc3c(s2)cc(cc3)OC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK597125
Synonyms: (4E)-1-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-[furan-2-yl(hydroxy)methylidene]-5-phenylpyrrolidine-2,3-dione
Smiles: CCCCSc1nnc(s1)N1C(c2ccccc2)/C(=C(/c2ccco2)\O)/C(=O)C1=O

STK597126
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3-nitrophenyl)carbonyl]-2'-[(4-propoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccc(c2)[N+](=O)[O-])N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK597127
Synonyms: 1-amino-4-[(4-methoxyphenyl)amino]-2-(morpholin-4-yl)anthracene-9,10-dione
Smiles: COc1ccc(cc1)Nc1cc(N2CCOCC2)c(c2c1C(=O)c1ccccc1C2=O)N

STK597129
Synonyms: 2-{5-[(3-methylbenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}ethanamine
Smiles: NCCc1nnc(o1)SCc1cccc(c1)C

STK597130
Synonyms: 4-(furan-2-ylmethyl)-3-[(4-methylphenoxy)methyl]-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)OCc1nnc(n1Cc1ccco1)SC/C=C/c1ccccc1

STK597132
Synonyms: 4-(4-methoxyphenyl)-3-[(4-methylbenzyl)sulfanyl]-5-(3-methylphenyl)-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)C)nnc1c1cccc(c1)C

STK597134
Synonyms: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-1-(4-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C1=O)S

STK597136
Synonyms: 4-chloro-N-[6-methyl-2,4-bis(4-methylphenyl)-5-oxo-2,5-dihydropyridazin-3-yl]benzamide
Smiles: Cc1ccc(cc1)n1nc(C)c(=O)c(c1NC(=O)c1ccc(cc1)Cl)c1ccc(cc1)C

STK597138
Synonyms: 6-(2,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: COc1ccc(cc1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1ccc(cc1OC)OC

STK597139
Synonyms: 2-({4-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-(diethylamino)phenyl]acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccc(cc1)C)CC

STK597140
Synonyms: 3-[(Z)-(3-cyclopentyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(2-fluorophenyl)piperazin-1-yl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2F)/C(=O)N1C1CCCC1

STK597141
Synonyms: N-[1-methyl-4-oxo-3-(3,4,5-trimethoxyphenyl)-1,4-dihydroquinolin-2-yl]-4-nitrobenzamide
Smiles: COc1cc(cc(c1OC)OC)c1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])n(C)c2c(c1=O)cccc2

STK597142
Synonyms: 7-chloro-N-methyl-5-phenyl-3H-1,4-benzodiazepin-2-amine4-oxide
Smiles: CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c1ccccc1)Cl

STK597143
Synonyms: 4-{[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl}-2-oxo-7-phenyl-2H-chromen-6-olate
Smiles: COc1ccc(cc1)N1CC[NH+](CC1)Cc1cc(=O)oc2c1cc([O-])c(c2)c1ccccc1

STK597144
Synonyms: N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(propan-2-yl)benzenesulfonamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccccc1)C(C)C

STK597145
Synonyms: 3-cyclohexyl-2-(furan-2-yl)-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: O=c1c2c(=O)n(C3CCCCC3)c(nc2n(c2c1cccc2)C)c1ccco1

STK597146
Synonyms: 3-(4-methoxyphenyl)-1',3'-dimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(cc1)N1CCN2C(C1)C1(Cc3c2cccc3)C(=O)N(C)C(=O)N(C1=O)C

STK597147
Synonyms: 7-(2-chlorobenzyl)-6-hydroxy-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1ccccc1Cl)c(O)nc(=O)n2C

STK597149
Synonyms: 7-(4-chlorophenyl)-3-(thiophen-2-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1ccc(cc1)n1ncc2c1ncn1c2nnc1c1cccs1

STK597150
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-(4-hydroxy-3-methoxyphenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1cc(ccc1O)C1N(CCCn2c[nH+]cc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/[O-]

STK597151
Synonyms: 2-[4-(2-fluorophenoxy)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Oc2ccccc2F)c2c(n1)cccc2

STK597152
Synonyms: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-[(1-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CSc1nc2c(n1C)cccc2

STK597153
Synonyms: 6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-8-(pyrrolidin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCCC1)COc1ccc(cc1)C

STK597154
Synonyms: (6E)-4-(1-benzofuran-2-yl)-6-[(4-ethylphenyl)imino]-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: CCc1ccc(cc1)/N=c/1\[nH]c(N)nc(n1)c1cc2c(o1)cccc2

STK597155
Synonyms: 4-(2-chloro-5-nitrophenyl)-8-methyl-2-[(4-methylphenyl)amino]-4,9-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Smiles: Cc1ccc(cc1)NC1=NC(c2cc(ccc2Cl)[N+](=O)[O-])n2c(=N1)[nH]c(cc2=O)C

STK597156
Synonyms: 8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl2-{[(benzyloxy)carbonyl]amino}butanoate
Smiles: CCC(C(=O)Oc1cc2oc(=O)c3c(c2cc1Cl)CCC3)NC(=O)OCc1ccccc1

STK597158
Synonyms: 2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK597159
Synonyms: 2-[(3-bromobenzyl)sulfanyl]-3-(4-bromophenyl)quinazolin-4(3H)-one
Smiles: Brc1ccc(cc1)n1c(SCc2cccc(c2)Br)nc2c(c1=O)cccc2

STK597161
Synonyms: N-(4-methoxyphenyl)-2-methyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1ccc(cc1)N(C(=O)c1ccccc1C)Cc1cc2cccc(c2[nH]c1=O)C

STK597162
Synonyms: 3-ethyl-8-(3-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC

STK597163
Synonyms: 2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(n1C)c1cccc(c1)Cl

STK597164
Synonyms: 11-chloro-3-(pyridin-3-ylmethyl)-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one
Smiles: Clc1cc2c(c3c1OCN(C3)Cc1cccnc1)oc(=O)c1c2CCC1

STK597165
Synonyms: {2-(4-methoxyphenyl)-1-(4-methylphenyl)-4-[(4-methylphenyl)amino]-5-oxo-2,5-dihydro-1H-pyrrol-3-yl}aceticacid
Smiles: COc1ccc(cc1)C1C(=C(C(=O)N1c1ccc(cc1)C)Nc1ccc(cc1)C)CC(=O)O

STK597166
Synonyms: N-(4-{(3E)-2-(2,4-dimethoxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}phenyl)acetamide
Smiles: COc1cc(OC)ccc1C1N(c2ccc(cc2)NC(=O)C)C(=O)C(=O)/C/1=C(\c1ccccc1)/O

STK597168
Synonyms: 1-[4-(3-methoxyphenyl)piperazin-1-yl]-3-(2-methyl-1H-benzimidazol-1-yl)propan-1-one
Smiles: COc1cccc(c1)N1CCN(CC1)C(=O)CCn1c(C)nc2c1cccc2

STK597169
Synonyms: 2-(4-fluorophenyl)-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Fc1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2

STK597172
Synonyms: 6-(2-phenylethyl)-1-(prop-2-en-1-yl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: C=CCn1c(S)nc(=O)c2c1NCN(C2)CCc1ccccc1

STK597173
Synonyms: 2-[4-(2,4-dichlorophenoxy)quinazolin-2-yl]-6-methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Oc2ccc(cc2Cl)Cl)c2c(n1)cccc2

STK597174
Synonyms: 6-[2-(hydroxymethyl)phenyl]-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: OCc1ccccc1n1cc2c(c1c1ccccc1)c(=O)n(c(=O)n2C)C

STK597175
Synonyms: 2-benzyl-1-(4-chlorophenyl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc(cc1)C1N(Cc2ccccc2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK597176
Synonyms: 1-(3,4-dimethoxyphenyl)-2-(6-fluoro-1,3-benzothiazol-2-yl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1OC)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK597177
Synonyms: 4-fluoro-N-[3-(2-fluorophenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1n(C)c2ccccc2c(=O)c1c1ccccc1F

STK597178
Synonyms: (2Z)-N-(3-methoxyphenyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanethioamide
Smiles: COc1cccc(c1)NC(=S)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK597179
Synonyms: (2E)-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-3-[4-(hexyloxy)-3-methoxyphenyl]prop-2-enamide
Smiles: CCCCCCOc1ccc(cc1OC)/C=C/C(=O)/N=c\1/sc2c([nH]1)cccc2

STK597180
Synonyms: (3a'S,6a'R)-7-chloro-5'-(2-methoxyethyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cccc2Cl

STK597183
Synonyms: (2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-1-[2-(thiophen-2-yl)quinolin-4-yl]ethanone
Smiles: COc1cc2CCN/C(=C\C(=O)c3cc(nc4c3cccc4)c3cccs3)/c2cc1OC

STK597184
Synonyms: (3a'S,6a'R)-5'-(2-methoxyethyl)-6,7-dimethyl-3'-(2-methylpropyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1ccc(c2C)C

STK597185
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Smiles: COc1ccc(c(c1)OC)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK597186
Synonyms: (4E)-5-(3-ethoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nnc(s1)C

STK597187
Synonyms: ethyl4-{[4-(butoxycarbonyl)phenyl]amino}-6-methylquinoline-3-carboxylate
Smiles: CCCCOC(=O)c1ccc(cc1)Nc1c(cnc2c1cc(C)cc2)C(=O)OCC

STK597188
Synonyms: N-[(2E)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-phenylpropanamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccccc1)CS(=O)(=O)C2)CCc1ccccc1

STK597189
Synonyms: 2,2,5-trimethyl-8-(pyrrolidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCCC1

STK597190
Synonyms: [2-chloro-5-(morpholin-4-ylsulfonyl)phenyl](6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1cc(ccc1Cl)S(=O)(=O)N1CCOCC1

STK597192
Synonyms: 1-(2-methoxyphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: COc1ccc(cc1)n1c(nnc1c1ccccn1)SCC(=O)c1ccccc1OC

STK597194
Synonyms: 2-[(3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]-N-(3-methoxypropyl)acetamide
Smiles: COCCCNC(=O)COc1cc(C)cc2c1c(C)c(c(=O)o2)Cc1ccccc1

STK597195
Synonyms: 4-(2,4-dimethoxyphenyl)-1-[3-(trifluoromethyl)phenyl]-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1ccc(c(c1)OC)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)C(F)(F)F

STK597196
Synonyms: 3-(3,4-dimethoxyphenyl)-7-(3,4-dimethylphenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: COc1cc(ccc1OC)C1=NOC2(C1)CC(=O)N(C2=O)c1ccc(c(c1)C)C

STK597197
Synonyms: 5-(4-fluorophenyl)-4-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)C

STK597198
Synonyms: N-[(3E)-1-ethyl-8-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-nitrobenzenesulfonamide
Smiles: CCn1[nH]/c(=N/S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])/c2c1nc1c(C)cccc1c2

STK597199
Synonyms: 1,7-dimethyl-8-phenyl-3-(3-phenylpropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1cn2c(n1c1ccccc1)nc1c2c(=O)n(CCCc2ccccc2)c(=O)n1C

STK597203
Synonyms: 5-(3-methylphenyl)-4-({(E)-[2-(trifluoromethyl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1C(F)(F)F

STK597204
Synonyms: methylN-[(4-carbamoylpiperidin-1-yl)carbonyl]-L-alaninate
Smiles: COC(=O)[C@@H](NC(=O)N1CCC(CC1)C(=O)N)C

STK597206
Synonyms: 2-(8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Smiles: NC(=O)Cn1c(CN2CCN(CC2)c2ccccc2F)nc2c1c(=O)n(c(=O)n2C)C

STK597207
Synonyms: (2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1ccc3c(c1)OCO3)/C2=O

STK597209
Synonyms: 4-{(E)-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazinylidene]methyl}quinoline
Smiles: c1ccc(cc1)c1csc2c1c(N/N=C/c1ccnc3c1cccc3)ncn2

STK597211
Synonyms: 6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(2-methylpropyl)hexanamide
Smiles: CC(CNC(=O)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C

STK597212
Synonyms: N'-[(1Z)-3-amino-1H-isoindol-1-ylidene]-4-hydroxybenzohydrazide
Smiles: Oc1ccc(cc1)C(=O)N/N=C/1\N=C(c2c1cccc2)N

STK597213
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[methyl(phenyl)amino]methyl}-N'-{(E)-[4-(propan-2-yloxy)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CC(Oc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N)C

STK597215
Synonyms: 4-(3,4-dimethylphenyl)-1-(4-ethylphenyl)-N-(3-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)C)cc3c1ccc(c(c1)C)C

STK597217
Synonyms: N'-(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)-N,N-dimethylethane-1,2-diamine
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCCN(C)C

STK597218
Synonyms: 9-(3-hydroxyphenyl)-6,6-dimethyl-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nn2c(n1)N=C1C(=C(O)CC(C1)(C)C)C2c1cccc(c1)O

STK597219
Synonyms: (1'S,3R,3'S,7a'S)-5''-chloro-1'-[(4-chlorophenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(Cl)cc1

STK597222
Synonyms: 5-(2-butoxyphenyl)-N'-[(E)-phenylmethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: CCCCOc1ccccc1c1[nH]nc(c1)C(=O)N/N=C/c1ccccc1

STK597226
Synonyms: 2-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(4-sulfamoylbenzyl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)NCc1ccc(cc1)S(=O)(=O)N

STK597231
Synonyms: (3a'S,6a'R)-5'-cyclohexyl-5-fluoro-3'-(4-hydroxybenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C1CCCCC1)Cc1ccc(cc1)O)C(=O)N2

STK597232
Synonyms: 6,8-dichloro-4-oxo-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-4H-chromene-2-carboxamide
Smiles: Clc1cc(Cl)c2c(c1)c(=O)cc(o2)C(=O)/N=c\1/[nH]nc(s1)C(C)C

STK597233
Synonyms: (2'S,3S,3'S,10b'R)-2'-{[4-(prop-2-en-1-yloxy)phenyl]carbonyl}-3'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: C=CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccs2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK597234
Synonyms: (4Z)-4-{[(2,4-dimethoxyphenyl)amino]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(OC)ccc1N/C=C\1/C(=NN(C1=O)c1ccccc1)C

STK597237
Synonyms: N-(2,5-dichlorophenyl)-2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1Cl)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK597240
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)SC

STK597241
Synonyms: 6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(2-methylphenyl)hexanamide
Smiles: O=C(Nc1ccccc1C)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK597242
Synonyms: 7-bromo-1-(3-methoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK597244
Synonyms: ethyl1-[(5-methoxy-3-methyl-1H-indol-2-yl)carbonyl]piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C(=O)c1[nH]c2c(c1C)cc(cc2)OC

STK597245
Synonyms: 4-({(E)-[3-(benzyloxy)phenyl]methylidene}amino)-5-(3-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)OCc1ccccc1

STK597247
Synonyms: N-{[2-(4-sulfamoylphenyl)ethyl]carbamoyl}-D-leucine
Smiles: CC(C[C@H](C(=O)O)NC(=O)NCCc1ccc(cc1)S(=O)(=O)N)C

STK597248
Synonyms: 4-{[(E)-(3-chlorophenyl)methylidene]amino}-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)Cl

STK597249
Synonyms: 3-[3-(dibutylamino)propyl]-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCCCN(CCCC)CCCn1cnc2c(c1=O)[nH]c1c2cc(cc1)OC

STK597250
Synonyms: 6-benzyl-2-[(2-fluorobenzyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Fc1ccccc1CNc1nn2c(n1)nc(c(c2O)Cc1ccccc1)C

STK597251
Synonyms: 2-(2-fluorophenyl)-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: COc1cc2c(cc1OC)CCn1c2cc(c2ccccc2F)c(c1=N)C#N

STK597252
Synonyms: 6-cyclohexyl-1-(pyridin-2-ylmethyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(S)n(c2c1CN(CN2)C1CCCCC1)Cc1ccccn1

STK597254
Synonyms: ethyl6'-amino-3'-methyl-2-oxo-1'-phenyl-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C31C(=O)Nc1c3cccc1)c(C)nn2c1ccccc1

STK597255
Synonyms: 2-({5-[(1S)-1-amino-2-(1H-indol-3-yl)ethyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(2,4-dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc(o1)[C@H](Cc1c[nH]c2c1cccc2)N

STK597256
Synonyms: N-(4-{[(3Z)-7-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]sulfamoyl}phenyl)acetamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)NC(=O)C)/c2c1nc1cc(C)ccc1c2

STK597259
Synonyms: 10-[3-(1H-imidazol-1-yl)propyl]-12-(4-methoxyphenyl)-10,12-dihydro-11H-benzo[5,6]chromeno[2,3-d]pyrimidin-11-imine
Smiles: COc1ccc(cc1)C1c2c(ccc3c2cccc3)Oc2c1c(=N)n(cn2)CCCn1cncc1

STK597260
Synonyms: 7-chloro-1-(4-ethoxy-3-methoxyphenyl)-2-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1OC)C1N(c2ccccn2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK597261
Synonyms: 3-[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(tetrahydrofuran-2-ylmethyl)propanamide
Smiles: O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)F)NCC1CCCO1

STK597262
Synonyms: N-(2-chlorobenzyl)-3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanamide
Smiles: O=C(NCc1ccccc1Cl)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK597264
Synonyms: (5Z)-6-hydroxy-3-(2-methylphenyl)-5-{1-[(2-phenylethyl)amino]ethylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: C/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/NCCc1ccccc1

STK597265
Synonyms: 3-[2-(cyclohex-1-en-1-yl)ethyl]-5-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cn1c2ccccc2c2c1c(=O)n(CCC1=CCCCC1)cn2

STK597266
Synonyms: N-(3-chloro-2-methylphenyl)-6-fluoro-2-methylquinoline-3-carboxamide
Smiles: Fc1ccc2c(c1)cc(c(n2)C)C(=O)Nc1cccc(c1C)Cl

STK597267
Synonyms: 2-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-[3-(1H-imidazol-1-yl)propyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)NCCCn1cncc1

STK597268
Synonyms: N-[(2Z)-5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-2-(2-oxo-1,3-benzothiazol-3(2H)-yl)acetamide
Smiles: O=C(Cn1c(=O)sc2c1cccc2)/N=c\1/[nH]nc(s1)SCc1ccccc1Cl

STK597269
Synonyms: 3-(1H-benzimidazol-1-yl)-N-[4-(diethylamino)phenyl]propanamide
Smiles: CCN(c1ccc(cc1)NC(=O)CCn1cnc2c1cccc2)CC

STK597270
Synonyms: 3-[(3-bromobenzyl)sulfanyl]-4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
Smiles: CCOc1ccc(cc1)n1c(SCc2cccc(c2)Br)nnc1c1cccc(c1)C

STK597271
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3-methoxyphenyl)carbonyl]-2'-[(4-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccc(c2)OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK597274
Synonyms: (3Z)-1-(4-chloro-2-methylphenoxy)-3-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)propan-2-one
Smiles: COc1cc2/C(=C/C(=O)COc3ccc(cc3C)Cl)/NCCc2cc1OC

STK597275
Synonyms: N-{1-[2-(5-chloro-1H-indol-3-yl)ethyl]-2-hydroxy-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl}benzamide
Smiles: Clc1ccc2c(c1)c(CCN1C(=NC(C1=O)(NC(=O)c1ccccc1)C(F)(F)F)O)c[nH]2

STK597276
Synonyms: 1-(2-bromophenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: O=C(c1ccccc1Br)CSc1nnc(n1c1ccccc1)c1cnccn1

STK597277
Synonyms: 3-{(2E)-2-[(1,2-dimethyl-1H-indol-3-yl)methylidene]hydrazinyl}-5H-[1,2,4]triazino[5,6-b]indole
Smiles: Cn1c2ccccc2c(c1C)/C=N/Nc1nnc2c(n1)[nH]c1c2cccc1

STK597279
Synonyms: 2-(5-{(Z)-[4-hydroxy-2,6-dioxo-1-(2,4,6-trimethylphenyl)-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-2-methoxybenzyl)-1H-isoindole-1,3(2H)-dione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=NC(=O)N(C1=O)c1c(C)cc(cc1C)C)O

STK597280
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,5-dimethylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)cc(c2)C)nnc1COc1ccc(cc1)Cl

STK597281
Synonyms: N-[(2,3-dichlorophenyl)carbamoyl]-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)Nc1cccc(c1Cl)Cl

STK597283
Synonyms: N-{3-[(furan-2-ylmethyl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}-5-(2-hydroxy-3,4-dimethylphenyl)-1H-pyrazole-3-carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1O)C)C)Nc1sc2c(c1C(=O)NCc1ccco1)CCC2

STK597284
Synonyms: 9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3-propyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)CCc1ccc(c(c1)OC)OC

STK597285
Synonyms: 2-[(2Z)-1,3-benzothiazol-2(3H)-ylideneamino]-4-methyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
Smiles: O=C(c1cnc(nc1C)/N=c/1\sc2c([nH]1)cccc2)Nc1cccc(c1)C(F)(F)F

STK597286
Synonyms: N-(3-chlorophenyl)-2-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1cccc(c1)Cl

STK597287
Synonyms: 5-tert-butyl-N-(3-chlorophenyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Clc1cccc(c1)Nc1cc(nc2n1ncc2c1ccccc1)C(C)(C)C

STK597288
Synonyms: 8-(2-methoxyphenyl)-1-methyl-3-(2-methylpropyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC(C)C

STK597290
Synonyms: 2-{(E)-[1-(4-fluorobenzyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-N-phenylhydrazinecarbothioamide
Smiles: S=C(Nc1ccccc1)NN/C=C/1\C(=NC(=O)N(C1=O)Cc1ccc(cc1)F)O

STK597291
Synonyms: (5Z)-3-butyl-5-[5-(2,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCCCN1C(=O)N=C(/C(=C\2/NNC(C2)c2ccc(cc2OC)OC)/C1=O)O

STK597292
Synonyms: 8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1cccc(c1)C)c(=O)n(c(=O)n2C)C

STK597293
Synonyms: (3R)-N-(2-chlorobenzyl)-6,7-dimethoxy-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: COc1c(OC)ccc2c1C(=O)N1C2SC[C@H]1C(=O)NCc1ccccc1Cl

STK597294
Synonyms: (8Z)-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-1,3-dimethyl-8-[(2Z)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)OCC(Cn1/c(=N\N=C\2/C(=O)Nc3c2cccc3)/[nH]c2c1c(=O)n(C)c(=O)n2C)O

STK597295
Synonyms: 16-(4-chlorophenyl)-3,3-dimethyl-2,3,4,6,7,11,12,16-octahydro-1H,10H-[1,4]dioxepino[2',3':6,7]isoquino[2,1-a]quinolin-1-one
Smiles: Clc1ccc(cc1)C1C=C2N(C3=C1C(=O)CC(C3)(C)C)CCc1c2cc2OCCCOc2c1

STK597297
Synonyms: 1,3,7,7-tetramethyl-5-phenyl-10-(thiophen-2-yl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1c1C(OCC(n1c2c1ccccc1)(C)C)c1cccs1

STK597298
Synonyms: 5-[(3,4-diethoxybenzyl)amino]-2-(morpholin-4-ium-4-yl)benzoate
Smiles: CCOc1cc(CNc2ccc(c(c2)C(=O)[O-])[NH+]2CCOCC2)ccc1OCC

STK597299
Synonyms: tert-butyl{(1S)-1-[6-(benzylsulfanyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-2-phenylethyl}carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc2n1nc(s2)SCc1ccccc1)Cc1ccccc1

STK597300
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-ethoxyphenyl)methylidene]-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1OCC

STK597301
Synonyms: N-(3-bromophenyl)-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: O=C(Nc1cccc(c1)Br)CCCn1cnc2c(c1=O)cccc2

STK597302
Synonyms: methylN-[(3-chloro-4-methylphenyl)carbamoyl]-L-valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)Nc1ccc(c(c1)Cl)C

STK597303
Synonyms: (5E)-5-({[4-(diethylamino)phenyl]amino}methylidene)-1-(4-methoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C\Nc2ccc(cc2)N(CC)CC)/C1=O)S

STK597304
Synonyms: tert-butyl[(2S)-1-({[trans-4-(1,3-benzodioxol-5-ylcarbamoyl)cyclohexyl]methyl}amino)-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Smiles: CSCC[C@@H](C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)Nc1ccc2c(c1)OCO2)NC(=O)OC(C)(C)C

STK597306
Synonyms: 2-[(2E)-{[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylidene}hydrazinylidene]-2,3-dihydro-1H-benzimidazole
Smiles: COc1cc(ccc1c1ccc(o1)/C=N/N=c/1\[nH]c2c([nH]1)cccc2)[N+](=O)[O-]

STK597310
Synonyms: 2-[3-(furan-2-ylmethyl)-4-imino-6,6-dimethyl-2-oxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl]-N-(2-methylphenyl)acetamide
Smiles: O=C(Cn1c2sc3c(c2c(=N)n(c1=O)Cc1ccco1)CC(OC3)(C)C)Nc1ccccc1C

STK597311
Synonyms: N-(2-methoxyphenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1c1ccccc1)c1ccccn1

STK597312
Synonyms: 5,6-dimethoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)NCc1cccnc1

STK597314
Synonyms: 4-({(E)-[3-(benzyloxy)-4-methoxyphenyl]methylidene}amino)-5-(3-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC

STK597316
Synonyms: 4-methyl-N-(2-methylpropyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: CC(CN(S(=O)(=O)c1ccc(cc1)C)Cc1cc2ccccc2[nH]c1=O)C

STK597317
Synonyms: (E)-1-(4-methoxyphenyl)-N-[(9-propyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]methanimine
Smiles: CCCN1CCc2c(C1)sc1c2c2nc(nn2cn1)CO/N=C/c1ccc(cc1)OC

STK597318
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)OCC)nnc1COc1ccc(cc1)Cl

STK597319
Synonyms: 3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-[4-(trifluoromethoxy)phenyl]propanamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK597320
Synonyms: methyl4-[(E)-{[3-(2-methylphenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1C

STK597324
Synonyms: 1-(4-tert-butylphenyl)-7-methyl-2-(5-methyl-1,3,4-thiadiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)C(C)(C)C)c1nnc(s1)C

STK597325
Synonyms: methylN-1,3-benzothiazol-2(3H)-ylidene-2-[bis(2-methylpropoxy)phosphoryl]-3,3,3-trifluoroalaninate
Smiles: COC(=O)C(P(=O)(OCC(C)C)OCC(C)C)(C(F)(F)F)/N=c\1/sc2c([nH]1)cccc2

STK597326
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(4-methoxyphenyl)carbonyl]-3'-{[4-(propan-2-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC(C)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK597328
Synonyms: 2-{4-[7-(4-fluorobenzyl)-6-hydroxy-3-methyl-2-oxo-3,7-dihydro-2H-purin-8-yl]piperazin-1-yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)F)c(O)nc(=O)n2C

STK597329
Synonyms: 6-butyl-4-(4-chlorophenyl)-2-methylpyridazino[3',4':4,5]pyrimido[1,6-a]benzimidazol-1(4H)-one
Smiles: CCCCc1nc2n(nc(c(=O)c2c2n1c1ccccc1n2)C)c1ccc(cc1)Cl

STK597330
Synonyms: N-[2-(2-hydroxyethoxy)ethyl]-10-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: OCCOCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CC(C)CC2

STK597334
Synonyms: (5Z)-2-[4-(naphthalen-1-yl)piperazin-1-yl]-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)N1CCN(CC1)c1cccc2c1cccc2

STK597336
Synonyms: 1-[(8-methyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino]propan-2-ol
Smiles: CC(CNc1nc2nnnn2c2c1c1CCN(Cc1s2)C)O

STK597338
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)C)nnc1c1cccc(c1)Cl

STK597341
Synonyms: methyl3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NS(=O)(=O)Cc1ccccc1)cc(cc2)F

STK597342
Synonyms: 3-(3-methylphenyl)-3,4-dihydro-2H-dibenzo[b,e][1,4]diazepin-1-ol
Smiles: Cc1cccc(c1)C1CC(=C2C(=Nc3ccccc3N=C2)C1)O

STK597344
Synonyms: 9-(2-methoxyethyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Smiles: COCCN1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK597345
Synonyms: 3-[(3a'S,6a'R)-5-bromo-5'-(2-methoxyethyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanoicacid
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)O)C(=O)Nc2c1cc(Br)cc2

STK597347
Synonyms: 6-(4-oxoquinazolin-3(4H)-yl)-N-(pyridin-2-yl)hexanamide
Smiles: O=C(Nc1ccccn1)CCCCCn1cnc2c(c1=O)cccc2

STK597348
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(2-fluorophenyl)-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1c1nnc(s1)SCc1cccc2c1cccc2)c1ccccc1F

STK597349
Synonyms: 10-(4-ethoxyphenyl)-1,3-dimethyl-5-phenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: CCOc1ccc(cc1)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C

STK597350
Synonyms: 4-[10-acetyl-3-(4-fluorophenyl)-1-hydroxy-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-11-yl]benzonitrile
Smiles: N#Cc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C)cccc2)c1ccc(cc1)F

STK597351
Synonyms: N-(4-chlorophenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1c1ccccc1)c1ccccn1

STK597354
Synonyms: (4-bromophenyl)(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc(cc1)Br

STK597355
Synonyms: 2-{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C)C)N=C2C(=C(O)CCC2)C1c1ccc(cc1)Cl

STK597357
Synonyms: 4-(4-chlorophenyl)-1-(4-ethylphenyl)-N-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)OC)n2c3c1CCCCn3c(c2)c1ccc(cc1)Cl

STK597358
Synonyms: 9-(3,5-difluorophenyl)-6-(4-fluorophenyl)-2-methyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Fc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2cc(F)cc(c2)F)nc(n3)C)C1)O

STK597359
Synonyms: 3-nitro-N-[2-(2-phenylethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]benzamide
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Nc1ccc2c(c1)nc1n2CCN(C1)CCc1ccccc1

STK597360
Synonyms: (4Z)-6-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-4-[(4-ethoxyphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: CCOc1ccc(cc1)/N=c/1\nc(N)nc([nH]1)CN1CCN(CC1)c1cccc(c1)Cl

STK597363
Synonyms: 5-[3-(propan-2-yloxy)phenyl]-4-{[(E)-pyridin-3-ylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccnc1)C

STK597364
Synonyms: 2-[(11-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]-N-phenylacetamide
Smiles: CC1CCc2c(C1)sc1c2c2ncnn2c2n1c(SCC(=O)Nc1ccccc1)nn2

STK597365
Synonyms: 1-[(2-chlorobenzyl)sulfanyl]-4-(3-chlorophenyl)-8-methyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCc1ccccc1Cl)nn2)c1cccc(c1)Cl

STK597366
Synonyms: 3-(3,4-dichlorobenzyl)-1,7,8-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1cc(ccc1Cl)Cn1c(=O)c2n3cc(n(c3nc2n(c1=O)C)C)C

STK597367
Synonyms: (5s,7s)-5-methyl-2-(4-methylphenyl)-7-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: Cc1ccc(cc1)C1N2C[C@@]3(CN1C[C@](C2)(C3=O)c1ccccc1)C

STK597368
Synonyms: N-[(3Z)-1-butyl-8-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-2-nitrobenzenesulfonamide
Smiles: CCCCn1[nH]/c(=N\S(=O)(=O)c2ccccc2[N+](=O)[O-])/c2c1nc1c(c2)cccc1C

STK597369
Synonyms: 3-[8-(3-chlorophenyl)-10-methyl-11-(pyridin-3-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]naphthalen-2-ol
Smiles: Clc1cccc(c1)n1nc(c2c1Oc1ncn3c(c1C2c1cccnc1)nc(n3)c1cc2ccccc2cc1O)C

STK597370
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(4-chlorophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl

STK597372
Synonyms: 3-[(4-nitrobenzyl)sulfanyl]-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-4-amine
Smiles: Nn1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1[nH]nc2c1CCC2

STK597373
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Smiles: O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK597374
Synonyms: (3a'S,6a'R)-5-bromo-5'-tert-butyl-3'-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Brc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C(C)(C)C)C)C(=O)N2

STK597377
Synonyms: 1-(4-methoxyphenyl)-N-(3-methylphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)C)cc3c1ccc(cc1)C

STK597381
Synonyms: 4-{5-[(E)-{2-[(2-hydroxyphenyl)carbonyl]hydrazinylidene}methyl]furan-2-yl}benzenesulfonamide
Smiles: O=C(c1ccccc1O)N/N=C/c1ccc(o1)c1ccc(cc1)S(=O)(=O)N

STK597383
Synonyms: 1,6,7-trimethyl-3-(2-phenylethyl)-8-(tetrahydrofuran-2-ylmethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cn1c(=O)n(CCc2ccccc2)c(=O)c2c1nc1n2c(c(n1CC1CCCO1)C)C

STK597384
Synonyms: 5-(3,4-dichlorophenyl)-N'-[(E)-(2,4-dichlorophenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: Clc1ccc(c(c1)Cl)/C=N/NC(=O)c1n[nH]c(c1)c1ccc(c(c1)Cl)Cl

STK597385
Synonyms: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-2-(1-methyl-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanamide
Smiles: O=c1n([C@H](C(=O)NCc2ccc3c(c2)OCO3)Cc2ccccc2)c(=O)c2c(n1C)cccc2

STK597386
Synonyms: 7,8-dimethoxy-1-methyl-3-phenyl-3H-pyrazolo[3,4-c]isoquinoline
Smiles: COc1cc2c(cc1OC)cnc1c2c(C)nn1c1ccccc1

STK597387
Synonyms: N-[5-hydroxy-2-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-2-phenylacetamide
Smiles: COc1ccc(cc1)c1nc2n(n1)c(NC(=O)Cc1ccccc1)cc(n2)O

STK597388
Synonyms: 2',6'-dihydroxy-12-methyl-15,16-dihydro-4'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-4',7-dione
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C

STK597389
Synonyms: N-cyclopentyl-4-methoxy-N-(thiophen-2-ylmethyl)benzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)N(C1CCCC1)Cc1cccs1

STK597391
Synonyms: 6-(4-fluorophenyl)-9-(4-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Cc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccc(cc1)F

STK597392
Synonyms: 9-[2-(difluoromethoxy)phenyl]-6-(2-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: FC(Oc1ccccc1C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1O)F

STK597393
Synonyms: 8-(4-ethoxyphenyl)-1,7-dimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCOc1ccc(cc1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK597395
Synonyms: 12-chloro-3-(2,4,6-trimethylphenyl)-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Smiles: Cc1cc(C)c(c(c1)C)N1COc2c(C1)c1oc(=O)c3c(c1cc2Cl)CCCC3

STK597396
Synonyms: 2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CSc1nnc(n1C)c1cccc(c1)Cl

STK597397
Synonyms: 2-{[4-(diphenylmethyl)piperazin-1-yl]methyl}quinazolin-4-ol
Smiles: Oc1nc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)nc2c1cccc2

STK597398
Synonyms: 12-(4-fluorophenyl)-2,3,4,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1-ol
Smiles: Fc1ccc(cc1)C1C2=C(O)CCCC2=Nc2n1c1ccccc1n2

STK597400
Synonyms: N-(2,4-dichlorophenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc(n1c1ccccc1)c1ccccn1

STK597402
Synonyms: (5Z)-5-{[5-(3-fluorophenyl)furan-2-yl]methylidene}-2-hydroxy-3-(prop-2-en-1-yl)-3,5-dihydro-4H-imidazol-4-one
Smiles: C=CCN1C(=N/C(=C\c2ccc(o2)c2cccc(c2)F)/C1=O)O

STK597405
Synonyms: ethyl3-[4-hydroxy-6-methyl-2-(N'-phenylcarbamimidamido)pyrimidin-5-yl]propanoate
Smiles: CCOC(=O)CCc1c(C)nc(nc1O)NC(=N)Nc1ccccc1

STK597406
Synonyms: 8-[4-(2-chloro-6-fluorobenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-(2-methylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1c(F)cccc1Cl)C

STK597407
Synonyms: 4-[(2E)-2-(3,4-dimethoxybenzylidene)hydrazinyl]benzoicacid
Smiles: COc1ccc(cc1OC)/C=N/Nc1ccc(cc1)C(=O)O

STK597409
Synonyms: (3a'S,6a'R)-5'-(1,3-benzodioxol-5-yl)-5-bromo-3'-(1H-indol-3-ylmethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Brc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)OCO3)Cc1c[nH]c3c1cccc3)C(=O)N2

STK597411
Synonyms: N-[3-(dipropylamino)propyl]-4-methyl-3-[4-(propan-2-yloxy)phenyl]pentanamide
Smiles: CCCN(CCC)CCCNC(=O)CC(c1ccc(cc1)OC(C)C)C(C)C

STK597412
Synonyms: methyl[8-(3-chlorophenyl)-1-methyl-2,4-dioxo-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl]acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cccc(c1)Cl

STK597413
Synonyms: (1'S,3R,3'S,7a'S)-7''-chloro-5''-methyl-1'-[(3-propoxyphenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCCOc1cccc(c1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(C)cc1Cl

STK597414
Synonyms: 1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-yl4-[(tert-butoxycarbonyl)amino]butanoate
Smiles: O=C(Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)CCCNC(=O)OC(C)(C)C

STK597415
Synonyms: (2Z)-1-(9H-fluoren-9-yl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Smiles: O=C(C1c2ccccc2c2c1cccc2)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK597416
Synonyms: 2-{[7,7-dimethyl-2-(3-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-1-(piperidin-1-yl)ethanone
Smiles: Cc1cccc(c1)c1nc(SCC(=O)N2CCCCC2)c2c(n1)CC(OC2)(C)C

STK597418
Synonyms: N-[3-(2-chlorophenyl)-4-oxo-4H-thiochromen-2-yl]thiophene-2-carboxamide
Smiles: O=C(c1cccs1)Nc1sc2ccccc2c(=O)c1c1ccccc1Cl

STK597419
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-fluorophenyl)carbonyl]-2'-{[4-(2-methylpropyl)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CC(Cc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C

STK597420
Synonyms: 4-{[(E)-anthracen-9-ylmethylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c2ccccc2cc2c1cccc2

STK597422
Synonyms: N'-[(E)-(3-hydroxy-4-methoxyphenyl)methylidene]-6-methoxy-1H-indole-2-carbohydrazide
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)N/N=C/c1ccc(c(c1)O)OC

STK597423
Synonyms: N-(4-butylphenyl)-3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanamide
Smiles: CCCCc1ccc(cc1)NC(=O)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK597425
Synonyms: 2-(ethylsulfanyl)-5-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: CCSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccc(c(c1)OC)O

STK597427
Synonyms: 2-(6-ethoxy-1,3-benzothiazol-2-yl)-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)cccc1

STK597428
Synonyms: (1E,2E)-1-{2-(4-chlorophenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}-3-phenylprop-2-en-1-olate
Smiles: Clc1ccc(cc1)C1/C(=C(/C=C/c2ccccc2)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STK597430
Synonyms: N-(4-methoxy-3-nitrophenyl)-1-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COc1ccc(cc1[N+](=O)[O-])NC(=O)c1cc2c(n1C)nc1n(c2=O)cccc1

STK597432
Synonyms: 6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-8-(nonylsulfanyl)-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCCCCCSc1nc2c(n1CC(=C)C)c(O)nc(=O)n2C

STK597434
Synonyms: 2-({5-[(4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-sulfamoylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1COc1ccc(cc1)C

STK597435
Synonyms: 2-(4-fluorophenyl)-3-[2-(4-methoxyphenyl)ethyl]-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COc1ccc(cc1)CCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccc(cc1)F

STK597436
Synonyms: 2-benzyl-7-fluoro-1-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccn1)Cc1ccccc1

STK597437
Synonyms: 2-[(2E)-{[5-(2,4-dichlorophenyl)furan-2-yl]methylidene}hydrazinylidene]-2,3-dihydro-1H-benzimidazole
Smiles: Clc1ccc(c(c1)Cl)c1ccc(o1)/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK597438
Synonyms: (3R)-N-[(2S)-1-(cyclopentylamino)-4-methyl-1-oxopentan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: CC(C[C@@H](C(=O)NC1CCCC1)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C

STK597439
Synonyms: N-(4-bromophenyl)-2-{[4-(4-chlorophenyl)-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccccc1c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)Br

STK597440
Synonyms: (1'S,3R,3'S,7a'S)-1'-[(4-chlorophenyl)carbonyl]-5'',7''-dimethyl-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(C)cc1C

STK597441
Synonyms: N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-5-methoxy-1H-indole-2-carbohydrazide
Smiles: COc1ccc(c(c1)/C=N/NC(=O)c1cc2c([nH]1)ccc(c2)OC)OC

STK597442
Synonyms: 5-(4-ethoxyphenyl)-4-{(2E)-2-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]hydrazinyl}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1N/N=C/C=C/c1ccco1

STK597443
Synonyms: 3-benzyl-1-[2-(piperidin-1-yl)ethyl]-1,5,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: O=c1c2c3CCCCCc3sc2n(c(=O)n1Cc1ccccc1)CCN1CCCCC1

STK597444
Synonyms: N-(2-hydroxyethyl)-5,10-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: Cc1nc2sc3c(c2c2n1nc(n2)C(=O)NCCO)CC(CC3)C

STK597446
Synonyms: N-[3-(1H-tetrazol-1-yl)phenyl]-4-(trifluoromethoxy)benzamide
Smiles: O=C(c1ccc(cc1)OC(F)(F)F)Nc1cccc(c1)n1cnnn1

STK597447
Synonyms: 3-{(3a'S,6a'R)-5'-[2-(3,4-dimethoxyphenyl)ethyl]-5-fluoro-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl}propanamide
Smiles: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3CCC(=O)N)C(=O)Nc3c2cc(F)cc3)ccc1OC

STK597448
Synonyms: 2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)c2nc3c(s2)cc(cc3)C)nnc1c1ccc(cc1)Cl

STK597449
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1cccc(c1)C

STK597450
Synonyms: N-[4-(2-oxo-4-phenyl-2H,8H-chromeno[8,7-e][1,3]oxazin-9(10H)-yl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1COc2c(C1)c1oc(=O)cc(c1cc2)c1ccccc1

STK597451
Synonyms: 2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1C)c1cccc(c1)Cl

STK597452
Synonyms: 8-hexyl-1,7-dimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCCCCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK597455
Synonyms: N-(4-methoxyphenyl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK597456
Synonyms: 6-(2-chloro-4-fluorobenzyl)-9-methyl-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one
Smiles: Fc1ccc(c(c1)Cl)Cn1c2ccc(cc2c2c1c(=O)n1c(n2)SCC1)C

STK597457
Synonyms: (3a'S,6a'R)-5'-(2,3-dihydro-1,4-benzodioxin-6-yl)-3'-(3,4-dihydroxybenzyl)-5-fluoro-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)OCCO3)Cc1ccc(c(c1)O)O)C(=O)N2

STK597460
Synonyms: 1-{[3-(3-methoxyphenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]methyl}-1H-indole-2,3-dione
Smiles: COc1ccc(cc1)C1CC(=NN1CN1c2ccccc2C(=O)C1=O)c1cccc(c1)OC

STK597461
Synonyms: (2E)-N-[2-(1H-imidazol-5-yl)ethyl]-3-phenylprop-2-enamide
Smiles: O=C(/C=C/c1ccccc1)NCCc1cnc[nH]1

STK597462
Synonyms: 4-({(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}amino)-5-(2-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(ccc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK597463
Synonyms: 4-({[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Smiles: N#Cc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK597464
Synonyms: 6-[(E)-(2-benzylhydrazinylidene)methyl]quinoline
Smiles: c1ccc(cc1)CN/N=C/c1ccc2c(c1)cccn2

STK597466
Synonyms: methyl(2E)-2-cyano-3-{3-methoxy-4-[(3-phenylpropanoyl)oxy]phenyl}prop-2-enoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)CCc1ccccc1)/C(=O)OC

STK597467
Synonyms: 8-ethoxy-N-nonyl-5H-pyrimido[5,4-b]indol-4-amine
Smiles: CCCCCCCCCNc1ncnc2c1[nH]c1c2cc(cc1)OCC

STK597468
Synonyms: ethyl2-({[(2R)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1NC(=O)N[C@@H](C(=O)OC)C(C)C

STK597471
Synonyms: 2-amino-4-(3-chlorophenyl)-5-hydroxy-7,9-dimethyl-4H-pyrano[2,3-d]thieno[3,2-b:5,4-b']dipyridine-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)Cl)c(O)nc1c2sc2c1c(C)cc(n2)C

STK597474
Synonyms: N-(biphenyl-2-yl)-2-{[5-(2-fluorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2c2ccccc2)nnc1c1ccccc1F

STK597475
Synonyms: 10-(4-hydroxy-3,5-dimethoxyphenyl)-1,3-dimethyl-5-(4-methylphenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: COc1cc(cc(c1O)OC)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccc(cc1)C)C

STK597476
Synonyms: (E)-{1-[2-(diethylammonio)ethyl]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/[O-])/C1c1ccc(cc1)[N+](=O)[O-])CC

STK597477
Synonyms: 1-hydroxy-9-oxo-9H-xanthen-3-ylN-[(benzyloxy)carbonyl]norleucinate
Smiles: CCCCC(C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1)NC(=O)OCc1ccccc1

STK597480
Synonyms: N'-[(E)-(4-hydroxyphenyl)methylidene]-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptane-1-carbohydrazide
Smiles: Oc1ccc(cc1)/C=N/NC(=O)C12CCC(C1)C(C2=C)(C)C

STK597481
Synonyms: N-[(2E)-5,5-dioxido-3-(prop-2-en-1-yl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(2-methoxyphenyl)acetamide
Smiles: C=CCN1/C(=N\C(=O)Cc2ccccc2OC)/SC2C1CS(=O)(=O)C2

STK597482
Synonyms: 2-{[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(n1N)c1n[nH]c(c1)C

STK597483
Synonyms: (4E)-5-(4-bromophenyl)-4-[hydroxy(4-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: Brc1ccc(cc1)C1NC(=O)C(=O)/C/1=C(\c1ccc(cc1)[N+](=O)[O-])/O

STK597484
Synonyms: 2-{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N,N-diphenylacetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)N(c2ccccc2)c2ccccc2)c2c(n1)CC(OC2)(C)C

STK597485
Synonyms: 6-methoxy-N'-[(E)-(4-methoxyphenyl)methylidene]-1H-indole-2-carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)cc(cc2)OC

STK597486
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3-methoxyphenyl)carbonyl]-2'-{[3-(prop-2-en-1-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: C=CCOc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2cccc(c2)OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK597487
Synonyms: tert-butyl[(1S)-2-(1H-indol-3-yl)-1-{5-[(3-methylbut-2-en-1-yl)sulfanyl]-1,3,4-oxadiazol-2-yl}ethyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)SCC=C(C)C)Cc1c[nH]c2c1cccc2

STK597488
Synonyms: N-[(2Z)-5,5-dioxido-3-[4-(propan-2-yl)phenyl]tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2,2-dimethylpropanamide
Smiles: O=C(C(C)(C)C)/N=C/1\SC2C(N1c1ccc(cc1)C(C)C)CS(=O)(=O)C2

STK597489
Synonyms: 5-{[(2Z)-3-(4-bromo-3-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)/N=C/1\SC2C(N1c1ccc(c(c1)C)Br)CS(=O)(=O)C2

STK597490
Synonyms: 5-(3,4-dimethoxyphenyl)-N'-[(1E)-1-(4-methoxyphenyl)ethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)c1n[nH]c(c1)c1ccc(c(c1)OC)OC)/C

STK597491
Synonyms: 6-hydroxy-3-methyl-7-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-8-(pyrrolidin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: Cc1nnc(s1)SCCn1c(nc2c1c(O)nc(=O)n2C)N1CCCC1

STK597492
Synonyms: 4-(4-bromophenyl)-7,7-dimethyl-2-phenyl-4,6,7,8-tetrahydro-2H-pyrazolo[3,4-b]quinoline-3,5-diol
Smiles: Brc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(O)n(n2)c1ccccc1)(C)C

STK597493
Synonyms: N-(3,5-dimethoxyphenyl)-2-({4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2CC)COc2ccc(cc2)C)cc(c1)OC

STK597494
Synonyms: 4-chloro-N-[(3Z)-1-ethyl-6-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)Cl)/c2c1nc1ccc(cc1c2)C

STK597496
Synonyms: methyl2-[(3E)-2-(4-hydroxyphenyl)-3-{hydroxy[4-(prop-2-en-1-yloxy)phenyl]methylidene}-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)c1nc(c(s1)C(=O)OC)C)/O

STK597497
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-fluorophenyl)carbonyl]-2'-[(4-pentylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK597498
Synonyms: 8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)Cc1nc2c(n1Cc1cccc3c1cccc3)c(=O)n(c(=O)n2C)C

STK597499
Synonyms: 9-(4-butylphenyl)-3-(2-methoxyethyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCOC

STK597500
Synonyms: 3-(1,3-benzodioxol-5-yl)-11-chloro-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one
Smiles: Clc1cc2c(c3c1OCN(C3)c1ccc3c(c1)OCO3)oc(=O)c1c2CCC1

STK597501
Synonyms: (4E)-5-(4-butoxy-3-ethoxyphenyl)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O

STK597502
Synonyms: 7-bromo-2-(3-hydroxypropyl)-1-(3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: OCCCN1C(=O)c2c(C1c1cccc(c1)OC)c(=O)c1c(o2)ccc(c1)Br

STK597503
Synonyms: (1'S,2'S,3R,3a'R)-1'-acetyl-2'-[(4-fluorophenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)C)N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)C

STK597505
Synonyms: N-(2-methoxyethyl)-2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: COCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C

STK597508
Synonyms: 3-(3,5-dimethoxybenzyl)-6-hydroxy-1',6'-dimethyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: COc1cc(cc(c1)OC)CN1C(=O)N=C(C2(C1=O)CN(C)c1c(C2)cc(cc1)C)O

STK597512
Synonyms: N-(biphenyl-2-yl)-2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2c2ccccc2)nnc1COc1ccccc1

STK597513
Synonyms: 6-methyl-2-[(3-methylphenyl)amino]-5-pentylpyrimidin-4-ol
Smiles: CCCCCc1c(C)nc(nc1O)Nc1cccc(c1)C

STK597514
Synonyms: 7-benzyl-6,10-dimethyl-3-(tetrahydrofuran-2-ylmethyl)-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: Cc1c2OCN(Cc2cc2c1oc(=O)c(c2C)Cc1ccccc1)CC1CCCO1

STK597515
Synonyms: N-(2-tert-butylphenyl)-2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccccc1C(C)(C)C)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK597516
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK597517
Synonyms: 3-{[5,6-di(furan-2-yl)furo[2,3-d]pyrimidin-4-yl]amino}propan-1-ol
Smiles: OCCCNc1ncnc2c1c(c1ccco1)c(o2)c1ccco1

STK597519
Synonyms: 4-{[(E)-(2-methoxynaphthalen-1-yl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1c(OC)ccc2c1cccc2

STK597521
Synonyms: 3-(3-methoxypropyl)-5-pentyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-ylhexanoate
Smiles: CCCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCCC)cccc3)CCCOC

STK597522
Synonyms: 7-(2,6-dichlorobenzyl)-1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCCCN1Cc1nc2c(n1Cc1c(Cl)cccc1Cl)c(=O)n(c(=O)n2C)C

STK597523
Synonyms: 1,3-dimethyl-7'-nitro-2'-phenyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc(ccc1N1C2CC(C1)c1ccccc1)[N+](=O)[O-]

STK597525
Synonyms: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C

STK597526
Synonyms: 3-[(3a'S,6a'R)-6-chloro-5'-(4-ethylphenyl)-7-methyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanamide
Smiles: CCc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1ccc(c2C)Cl

STK597527
Synonyms: methyl4-[2-(6-ethoxy-1,3-benzothiazol-2-yl)-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)C(=O)OC)c(=O)c1c(o2)cccc1

STK597531
Synonyms: (4E)-1-butyl-4-[hydroxy(phenyl)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)OC

STK597532
Synonyms: pentyl(10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-ylsulfanyl)acetate
Smiles: CCCCCOC(=O)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CCCC3

STK597534
Synonyms: N-(2,4-dimethoxyphenyl)-2-({5-[(4-methoxybenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)CSc1nnc(s1)SCC(=O)Nc1ccc(cc1OC)OC

STK597535
Synonyms: 5-(4-bromophenyl)-3-(2-hydroxyphenyl)-1-(1H-indol-3-ylmethyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: Brc1ccc(cc1)N1C(=O)C2C(C1=O)C(NC2c1ccccc1O)(Cc1c[nH]c2c1cccc2)C(=O)O

STK597537
Synonyms: 6,7-dimethoxy-1-methyl-2-[(3-methylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2c(cc1OC)CCN(C2C)S(=O)(=O)c1cccc(c1)C

STK597539
Synonyms: (2E)-3-(1,3-benzodioxol-5-yl)-N-[2-(1H-imidazol-5-yl)ethyl]prop-2-enamide
Smiles: O=C(/C=C/c1ccc2c(c1)OCO2)NCCc1cnc[nH]1

STK597540
Synonyms: (1'R,2'R)-1'-[(4-chlorophenyl)carbonyl]-2'-(pyridin-3-yl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1cccnc1)C(=O)c1c(C2=O)cccc1

STK597542
Synonyms: 3-[(3-chlorophenyl)sulfonyl]-9,10-dimethoxy-2-phenyl-6,7-dihydro-2H-pyrido[2,1-a]isoquinolin-4-amine
Smiles: COc1cc2c(cc1OC)CCN1C2=CC(c2ccccc2)C(=C1N)S(=O)(=O)c1cccc(c1)Cl

STK597543
Synonyms: 1-ethyl-2-methyl-1'-pentyl-2H,2'H,4H-spiro[dipyrido[1,2-a:2',3'-d]pyrimidine-3,5'-pyrimidine]-2',4',5,6'(1H,1'H,3'H)-tetrone
Smiles: CCCCCN1C(=O)NC(=O)C2(C1=O)Cc1c(N(C2C)CC)nc2n(c1=O)cccc2

STK597544
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1OC)OC

STK597545
Synonyms: 6-hydroxy-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-8-{[3-(1H-imidazol-1-yl)propyl]amino}-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(NCCCn2cncc2)nc2c1c(O)nc(=O)n2C)COc1cccc(c1)C

STK597546
Synonyms: (5E)-2-[4-(2-methylphenyl)piperazin-1-yl]-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1ccc(o1)c1cccc(c1)C(F)(F)F)N1CCN(CC1)c1ccccc1C

STK597547
Synonyms: 2-{[7,7-dimethyl-2-(3-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C

STK597549
Synonyms: N-(2,6-difluorophenyl)-2-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)acetamide
Smiles: COc1cc2c(cc1OC)CCN(C2C)CC(=O)Nc1c(F)cccc1F

STK597550
Synonyms: N-(prop-2-en-1-ylcarbamoyl)-D-leucine
Smiles: C=CCNC(=O)N[C@@H](C(=O)O)CC(C)C

STK597551
Synonyms: 4-{[(E)-(4-tert-butylphenyl)methylidene]amino}-5-(4-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)(C)C

STK597552
Synonyms: methylN-{(E)-[1-(naphthalen-1-yl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=O)N=C(N(C1=O)c1cccc2c1cccc2)S

STK597553
Synonyms: (5E)-5-(1-{2-[2-(diethylamino)ethyl]hydrazinyl}ethylidene)-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CCN(CCNN/C(=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)/C)CC

STK597554
Synonyms: N-(4-{(3E)-2-(4-chlorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}phenyl)acetamide
Smiles: Clc1ccc(cc1)C1/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C(=O)N1c1ccc(cc1)NC(=O)C

STK597556
Synonyms: (E)-[3-fluoro-4-(propan-2-yloxy)phenyl]{2-(4-methoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(c(c2)F)OC(C)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

STK597558
Synonyms: 3-benzyl-4-methyl-9-[2-(morpholin-4-yl)ethyl]-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: O=c1oc2c3CN(CCN4CCOCC4)COc3ccc2c(c1Cc1ccccc1)C

STK597559
Synonyms: 7-chloro-9-(methylsulfanyl)-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CSc1nc(Cl)c2c(n1)c1c(s2)nc(c2c1CCC2)C(C)C

STK597560
Synonyms: 2-(4-chlorophenyl)-3-{2-[2-(2,5-dimethylphenoxy)ethoxy]ethyl}quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1cc(C)ccc1C

STK597561
Synonyms: [4-({(2'S,3S,3'S,10b'R)-3'-[(2-chlorophenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2'-yl}carbonyl)phenoxy]acetonitrile
Smiles: N#CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK597562
Synonyms: (3E)-4-imino-3-(thiophen-2-ylmethylidene)-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one
Smiles: O=C1N=c2sc3c(n2C(=N)/C/1=C\c1cccs1)cccc3

STK597565
Synonyms: 8-(3,5-dimethylphenyl)-1,6,7-trimethyl-3-(2-oxopropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(=O)Cn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)c1cc(C)cc(c1)C

STK597566
Synonyms: 2-{(2E)-[(5-methoxy-1H-indol-3-yl)methylidene]hydrazinylidene}-2,3-dihydro-1H-benzimidazole
Smiles: COc1ccc2c(c1)c(/C=N/N=c/1\[nH]c3c([nH]1)cccc3)c[nH]2

STK597567
Synonyms: 2-hydroxy-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]benzohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)c1ccccc1O)OC

STK597568
Synonyms: N-(2,4-dimethoxyphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2OC)OC)nnc1c1ccccn1

STK597569
Synonyms: 7-benzyl-8-[(4-benzylpiperidin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2Cc1ccccc1)CN1CCC(CC1)Cc1ccccc1

STK597572
Synonyms: 2-[(12,12-dimethyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C

STK597573
Synonyms: N-[2-(2-acetyl-4,5-dimethoxyphenyl)ethyl]-4-[(methylsulfanyl)methyl]benzamide
Smiles: CSCc1ccc(cc1)C(=O)NCCc1cc(OC)c(cc1C(=O)C)OC

STK597575
Synonyms: 3-methyl-1',3'-bis(4-methylphenyl)-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CC1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N(c2ccc(cc2)C)C(=O)N(C1=O)c1ccc(cc1)C

STK597577
Synonyms: 5-hydroxy-7-(4-methoxyphenyl)-2-oxo-N-(4-phenoxyphenyl)-2,3,4,6,7,8-hexahydroquinoline-4-carboxamide
Smiles: COc1ccc(cc1)C1CC(=C2C(=NC(=O)CC2C(=O)Nc2ccc(cc2)Oc2ccccc2)C1)O

STK597578
Synonyms: 2-amino-N'-[(1Z)-3-amino-1H-isoindol-1-ylidene]benzohydrazide
Smiles: O=C(c1ccccc1N)N/N=C/1\N=C(c2c1cccc2)N

STK597579
Synonyms: N-(3-fluorophenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1c1ccccn1

STK597580
Synonyms: 9-methyl-3-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CC(CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2)/C1=O)C

STK597582
Synonyms: methylN-[(3,5-dimethoxyphenyl)carbamoyl]-L-valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)Nc1cc(OC)cc(c1)OC

STK597584
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK597585
Synonyms: 4-(benzylsulfanyl)-2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: COc1ccc(cc1)c1nc(SCc2ccccc2)c2c(n1)CC(OC2)(C)C

STK597586
Synonyms: N-{(2S)-1-[(4-fluorobenzyl)amino]-3-methyl-1-oxobutan-2-yl}-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)F)C(C)C

STK597587
Synonyms: 5-(2-hydroxy-4,5-dimethylphenyl)-N-(4-methoxybenzyl)-1H-pyrazole-3-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1n[nH]c(c1)c1cc(C)c(cc1O)C

STK597588
Synonyms: 6-(4-methoxyphenyl)-10-methyl-3-(pyridin-3-ylmethyl)-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1cc1CN(COc1c2C)Cc1cccnc1

STK597590
Synonyms: 1-(furan-2-yl)-2-[6-(propan-2-yl)-1,3-benzothiazol-2-yl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CC(c1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccco1)c(=O)c1c(o2)cccc1)C

STK597591
Synonyms: 2-{[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nnc(n1N)c1n[nH]c(c1)C

STK597593
Synonyms: 3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl(3,4,5-triethoxyphenyl)methanone
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK597595
Synonyms: (1'R,2'R)-1'-[(4-fluorophenyl)carbonyl]-2'-[4-(propan-2-yl)phenyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)C(C)C)C(=O)c1c(C2=O)cccc1

STK597596
Synonyms: 2-ethyl-3-methyl-1-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1cccnc1)c1ccccc1n2

STK597598
Synonyms: (10'R,11'R)-11'-acetyl-10'-(2-ethoxyphenyl)-10',11'-dihydro-8a'H-spiro[indene-2,9'-pyrrolo[1,2-a][1,10]phenanthroline]-1,3-dione
Smiles: CCOc1ccccc1[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2c2ncccc2cc1

STK597599
Synonyms: 1-(1',3'-dimethyl-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)-3-propan-2-ylthiourea
Smiles: CC(NC(=S)Nc1ccc2c(c1)CC1(C3N2CCCC3)C(=O)N(C)C(=O)N(C1=O)C)C

STK597602
Synonyms: (3a'S,6a'R)-5'-butyl-3'-(4-hydroxybenzyl)-5,7-dimethyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(C)cc2C

STK597603
Synonyms: 8-hexyl-1,6,7-trimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCCCCCn1c(C)c(n2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1)C

STK597605
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(5-methylfuran-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc(o1)C1N(c2nc3c(s2)cc(cc3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK597606
Synonyms: N-[3-(2-methoxyphenyl)-1',3'-dimethyl-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl]acetamide
Smiles: COc1ccccc1N1CCN2C(C1)C1(Cc3c2ccc(c3)NC(=O)C)C(=O)N(C)C(=O)N(C1=O)C

STK597607
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2,4-dichlorophenyl)carbonyl]-2'-[(4-nitrophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Clc1ccc(c(c1)Cl)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3

STK597608
Synonyms: 2-(2-{[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl]amino}ethoxy)ethanol
Smiles: OCCOCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C

STK597610
Synonyms: (2E)-N-[(2E)-5-benzyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2(1H)-ylidene]-2-cyano-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-enamide
Smiles: N#C/C(=C\c1ccc(o1)c1ccc(cc1Cl)Cl)/C(=O)/N=c\1/sc2c([nH]1)CCN(C2)Cc1ccccc1

STK597611
Synonyms: 4-({(E)-[3-(benzyloxy)-4-methoxyphenyl]methylidene}amino)-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK597613
Synonyms: 6-(4-methoxyphenyl)-9-(thiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2cccs2)ncn3)C1)O

STK597614
Synonyms: N-(2,6-difluorophenyl)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1c(F)cccc1F

STK597615
Synonyms: (2Z)-2-(4-tert-butylbenzylidene)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)C(C)(C)C)/C2=O

STK597616
Synonyms: 2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2cc(C)ccc2OC)nnc1c1cccc(c1)Cl

STK597617
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-methylpropanamide
Smiles: Fc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)N(C1CCS(=O)(=O)C1)C

STK597618
Synonyms: (2'S,3S,3'S,10b'R)-3'-(1,3-benzodioxol-5-ylcarbonyl)-2'-[(4-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc3c(c2)OCO3)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK597621
Synonyms: 8,8-dimethyl-3-(2-oxo-2-phenylethyl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4(3H)-one
Smiles: O=C(c1ccccc1)Cn1cnc2c(c1=O)oc1c2cc2c(n1)CC(OC2)(C)C

STK597622
Synonyms: 2-[(3-hydroxypropyl)amino]-3-[(Z)-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: OCCCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccc(cc1)OC

STK597624
Synonyms: 2-ethyl-1-{(2E)-2-[(2-hydroxy-7-methoxyquinolin-3-yl)methylidene]hydrazinyl}-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1cc3ccc(cc3nc1O)OC)c1ccccc1n2

STK597625
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: C=CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)/C1=O

STK597627
Synonyms: 2-(6-methoxy-1,3-benzothiazol-2-yl)-7-methyl-1-(thiophen-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccs1)c(=O)c1c(o2)ccc(c1)C

STK597628
Synonyms: 8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(2-oxopropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=O)Cn1c(CN2CCN(CC2)c2ccccc2F)nc2c1c(=O)n(c(=O)n2C)C

STK597629
Synonyms: 1-[1-hydroxy-3,3-dimethyl-11-(3-methylthiophen-2-yl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone
Smiles: OC1=C2C(=Nc3c(N(C2c2sccc2C)C(=O)C)cccc3)CC(C1)(C)C

STK597630
Synonyms: 4-({(2'S,3S,3'S,10b'R)-2'-[(2,4-dichlorophenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl}carbonyl)phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1Cl)Cl)C(=O)Nc1c2cccc1)cccc3

STK597632
Synonyms: 8-hydrazinyl-6-hydroxy-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: NNc1nc2c(n1CC(COc1cccc(c1)C)O)c(O)nc(=O)n2C

STK597633
Synonyms: 1',3'-dimethyl-2-nitro-7,11b-dihydro-2'H,6H,13H-spiro[isoquino[2,1-a]quinoline-12,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc(ccc1N1C2c2ccccc2CC1)[N+](=O)[O-]

STK597635
Synonyms: methyl4-(2-oxo-3,4a,5,6,7,8,8a,9-octahydro-2H-5,8-methanothiochromeno[2,3-d][1,3]thiazol-9-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2C3CCC(C2Sc2c1sc(=O)[nH]2)C3

STK597636
Synonyms: 2-[(12,12-dimethyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C

STK597637
Synonyms: 2,10-dimethyl-3-propylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCn1c(C)nc2c(c1=O)c(=O)c1c(n2C)cccc1

STK597638
Synonyms: methylN-[(1-phenylethyl)carbamoyl]-L-valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)NC(c1ccccc1)C

STK597639
Synonyms: 3-[2-(4-fluorophenyl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Fc1ccc(cc1)CCn1cnc2c(c1=O)[nH]c1c2cccc1

STK597642
Synonyms: 8-(4-ethoxyphenyl)-4-hydroxy-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purin-2(6H)-one
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(O)nc(=O)n1C

STK597643
Synonyms: N-(2-chlorophenyl)-1,4-diphenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Clc1ccccc1NC(=O)c1c(c2ccccc2)c2c3n1cc(n3CCCC2)c1ccccc1

STK597645
Synonyms: 10-methyl-3-(3-methylbutyl)-2-(4-methylphenyl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CC(CCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccc(cc1)C)C

STK597646
Synonyms: (3S,3'S,3a'R,6a'S)-7-chloro-3'-(3,4-dihydroxybenzyl)-5'-(tetrahydrofuran-2-ylmethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: O=C1N(CC2CCCO2)C(=O)[C@H]2[C@@H]1[C@H](Cc1ccc(c(c1)O)O)N[C@]12C(=O)Nc2c1cccc2Cl

STK597647
Synonyms: 1-ethyl-2'-hydroxy-1',2-dimethyl-2H,4H,4'H-spiro[dipyrido[1,2-a:2',3'-d]pyrimidine-3,5'-pyrimidine]-4',5,6'(1H,1'H)-trione
Smiles: CCN1c2nc3ccccn3c(=O)c2CC2(C1C)C(=O)N=C(N(C2=O)C)O

STK597648
Synonyms: N-[3-(diethylamino)propyl]-3-(2-methoxyphenyl)-3-methylpentanamide
Smiles: CCN(CCCNC(=O)CC(c1ccccc1OC)(CC)C)CC

STK597649
Synonyms: 4-{[(E)-(2,6-dichlorophenyl)methylidene]amino}-5-[4-(dimethylamino)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cccc(c1/C=N/n1c(=S)[nH]nc1c1ccc(cc1)N(C)C)Cl

STK597651
Synonyms: N'-[(E)-(3-hydroxy-4-methoxyphenyl)methylidene]-4,6-dimethoxy-1H-indole-2-carbohydrazide
Smiles: COc1cc(OC)c2c(c1)[nH]c(c2)C(=O)N/N=C/c1ccc(c(c1)O)OC

STK597657
Synonyms: 9-(3-bromophenyl)-6-(2,4-dimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(c(c1)OC)C1CC(=C2C(=Nc3n(C2c2cccc(c2)Br)ncn3)C1)O

STK597659
Synonyms: 9-chloro-2-(3,4-dimethoxyphenyl)-5-(4-ethoxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: CCOc1ccc(cc1OC)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(c(c1)OC)OC)Cl

STK597660
Synonyms: N-[3-(4-bromophenyl)-4-oxo-4H-thiochromen-2-yl]-4-nitrobenzamide
Smiles: Brc1ccc(cc1)c1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])sc2c(c1=O)cccc2

STK597661
Synonyms: 7'-{[(E)-(1-hexyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]amino}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCCCCN1C(=NC(=O)/C(=C\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)S

STK597662
Synonyms: N-(1-benzylpiperidin-4-yl)-5,6-dimethoxy-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)NC1CCN(CC1)Cc1ccccc1

STK597663
Synonyms: 2-({[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1H-benzimidazole
Smiles: COc1ccc(cc1)n1c(SCc2nc3c([nH]2)cccc3)nnc1c1ccccn1

STK597664
Synonyms: 8-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Clc1ccc(c(c1)N1CCN(CC1)Cc1[nH]c2c(n1)n(C)c(=O)nc2O)C

STK597665
Synonyms: methyl[8-(4-chlorocyclohexa-1,2,3,5-tetraen-1-yl)-1-methyl-2,4-dioxo-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl]acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)C1=C=C=C(C=C1)Cl

STK597666
Synonyms: (4E)-4-{[(4-acetylphenyl)amino]methylidene}-2-(2-methoxyphenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccccc1N1C(=O)/C(=C/Nc2ccc(cc2)C(=O)C)/c2c(C1=O)cccc2

STK597668
Synonyms: N-[(2E)-5,5-dioxido-3-[4-(propan-2-yl)phenyl]tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: CC(c1ccc(cc1)N1/C(=N\C(=O)C(C)C)/SC2C1CS(=O)(=O)C2)C

STK597671
Synonyms: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CC12CC3CC(C2)CC(C1)C3

STK597672
Synonyms: 2-{2-[(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)amino]ethoxy}ethanol
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCCOCCO

STK597673
Synonyms: 2-[(2-chlorobenzyl)sulfanyl]-9-(4-hydroxy-3-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1cc(ccc1O)C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1ccccc1Cl

STK597675
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluoro-4-methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1COc1ccc(cc1)Cl

STK597676
Synonyms: 4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(3-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1Br)/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl

STK597677
Synonyms: (3a'S,6a'R)-5-chloro-5'-(3-methoxypropyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cc(Cl)cc2

STK597679
Synonyms: 2-amino-4-(4-ethoxy-3-methoxyphenyl)-5-hydroxy-7-methyl-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Smiles: CCOc1ccc(cc1OC)C1C(=C(N)Oc2c1c(O)nc(c2)C)C#N

STK597680
Synonyms: (5Z)-1-methyl-5-{[5-(piperidin-1-yl)furan-2-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=NC(=O)/C(=C/c2ccc(o2)N2CCCCC2)/C1=O)S

STK597681
Synonyms: N-[4-(6-oxo-6,7,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-3(4H)-yl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1COc2c(C1)c1oc(=O)c3c(c1cc2)CCC3

STK597682
Synonyms: (2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethoxy)phenyl]propanamide
Smiles: O=C([C@@H](n1c(O)nc2c(c1=O)cccc2)C)Nc1ccc(cc1)OC(F)(F)F

STK597683
Synonyms: N-[3-(diethylamino)propyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CCN(CCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CCCC2)CC

STK597684
Synonyms: N-[2-(diethylamino)ethyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CCN(CCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CCCC2)CC

STK597685
Synonyms: 3-(2,6-dichlorobenzyl)-8-(3-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1c(Cl)cccc1Cl

STK597688
Synonyms: (5-bromo-3-methyl-1H-indol-2-yl)(4-ethylpiperazin-1-yl)methanone
Smiles: CCN1CCN(CC1)C(=O)c1[nH]c2c(c1C)cc(cc2)Br

STK597689
Synonyms: N-(4-bromo-3-methylphenyl)-2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)Br)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK597690
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]acetamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)COc1cc(C)cc2c1c1CCCc1c(=O)o2

STK597691
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK597692
Synonyms: (4E)-5-(4-ethylphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nccs1

STK597694
Synonyms: 8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(CN2CCN(CC2)c2ccccc2F)nc2c1c(=O)n(c(=O)n2C)C

STK597696
Synonyms: 8-[(E)-(1-tert-butyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1',3,3'-trimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)/C=C/2\C(=O)NC(=O)N(C2=O)C(C)(C)C)C(=O)N(C)C(=O)N(C1=O)C

STK597697
Synonyms: (5E)-5-({1-[2-(4-fluorophenoxy)ethyl]-1H-indol-3-yl}methylidene)-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Fc1ccc(cc1)OCCn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccco1)O

STK597698
Synonyms: 6-chloro-7-{(E)-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazinylidene]methyl}[1,3]dioxolo[4,5-g]quinoline
Smiles: Clc1nc2cc3OCOc3cc2cc1/C=N/Nc1ncnc2c1c(cs2)c1ccccc1

STK597699
Synonyms: N'-{(1E)-1-[4-hydroxy-1-(4-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]propyl}pyridine-4-carbohydrazide
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/NNC(=O)c1ccncc1

STK597700
Synonyms: (5E)-5-({[4-(dimethylamino)phenyl]amino}methylidene)-3-(3,4-dimethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\Nc2ccc(cc2)N(C)C)/C(=O)N1c1ccc(c(c1)C)C

STK597702
Synonyms: 8-[4-(2-chloro-6-fluorobenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-(3-methylbutyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1c(F)cccc1Cl)C

STK597704
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(cc1)[N+](=O)[O-]

STK597705
Synonyms: 7-methyl-2-(6-methyl-1,3-benzothiazol-2-yl)-1-(thiophen-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc2c(c1)sc(n2)N1C(c2cccs2)c2c(C1=O)oc1c(c2=O)cc(cc1)C

STK597706
Synonyms: methyl4-[2-(2-hydroxy-2-phenylethyl)-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(CC(c2ccccc2)O)C(=O)c2c1c(=O)c1c(o2)cccc1

STK597709
Synonyms: 4-butyl-6-chloro-2-oxo-2H-chromen-7-yl[(tert-butoxycarbonyl)amino](phenyl)acetate
Smiles: CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)C(c1ccccc1)NC(=O)OC(C)(C)C

STK597710
Synonyms: N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-5-{4-[(4-methylbenzyl)oxy]phenyl}-1H-pyrazole-3-carbohydrazide
Smiles: Cc1ccc(cc1)COc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1ccc(cc1)N(C)C

STK597713
Synonyms: N-[3-(1,3-benzodioxol-5-yl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]pentanamide
Smiles: CCCCC(=O)Nc1c(c2ccc3c(c2)OCO3)c(=O)c2c(n1C)cccc2

STK597715
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)C(F)(F)F)Cl)nnc1c1cccc(c1)C

STK597717
Synonyms: 1-{5-chloro-4-[(2-methoxyethyl)amino]-6-oxopyridazin-1(6H)-yl}tricyclo[3.3.1.1~3,7~]decane-2-carboxylicacid
Smiles: COCCNc1cnn(c(=O)c1Cl)C12CC3CC(C1)CC(C2C(=O)O)C3

STK597719
Synonyms: N-cyclopropyl-2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)F)NC1CC1

STK597721
Synonyms: N-(naphthalen-1-yl)-2-(10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-ylsulfanyl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CCCC3

STK597722
Synonyms: 2-[(6-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide
Smiles: O=C(C(Oc1cc2oc(=O)cc(c2cc1Cl)C)C)NCCCN1CCCC1=O

STK597723
Synonyms: N-[3-(5-methyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanoyl]norvalyl-S-benzyl-D-cysteine
Smiles: CCCC(C(=O)N[C@@H](C(=O)O)CSCc1ccccc1)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1

STK597724
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(2-methoxyphenyl)carbonyl]-2'-(phenylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)cccc3

STK597726
Synonyms: N-[4-(dimethylamino)phenyl]-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1cccc(c1)C

STK597729
Synonyms: (5E)-3-(4-chlorophenyl)-6-hydroxy-5-[(piperidin-1-ylamino)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C\NN2CCCCC2)/C1=O)O

STK597730
Synonyms: 2-[2-amino-5-(2-methoxyphenyl)-6-methylpyrimidin-4-yl]-5-[(4-methylbenzyl)oxy]phenol
Smiles: COc1ccccc1c1c(C)nc(nc1c1ccc(cc1O)OCc1ccc(cc1)C)N

STK597732
Synonyms: N-[2-(cyclohex-1-en-1-yl)ethyl]-5-methoxy-3-methyl-1H-indole-2-carboxamide
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)NCCC1=CCCCC1

STK597733
Synonyms: methylN-[(3,4-dimethylphenyl)carbamoyl]-D-leucinate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc(c(c1)C)C)CC(C)C

STK597734
Synonyms: 2-(6-chloro-1,3-benzothiazol-2-yl)-1-(2,5-dimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(c(c1)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)c2c1c(=O)c1c(o2)cccc1)OC

STK597735
Synonyms: N-(2-ethoxyphenyl)-2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2OCC)nnc1COc1ccc(cc1)C

STK597736
Synonyms: (3S)-N-[(2R)-1-oxo-1-(propylamino)propan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: CCCNC(=O)[C@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK597738
Synonyms: 4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1OC)/C=N/n1c(=S)[nH]nc1c1ccccc1OC

STK597739
Synonyms: {4-[4-([1]benzofuro[3,2-d]pyrimidin-4-ylamino)phenyl]piperazin-1-yl}(4-chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(cc1)Nc1ncnc2c1oc1c2cccc1

STK597740
Synonyms: 2-[(3a'S,6a'R)-5-chloro-5'-(2-chlorobenzyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: NC(=O)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cc(Cl)cc1

STK597741
Synonyms: 5-[(4-methylphenyl)amino]-1,3,4-thiadiazole-2(3H)-thione
Smiles: Cc1ccc(cc1)Nc1n[nH]c(=S)s1

STK597742
Synonyms: 2-(6-methoxy-1,3-benzothiazol-2-yl)-1-[4-(prop-2-en-1-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: C=CCOc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)OC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK597743
Synonyms: N-[2-(cyclohex-1-en-1-yl)ethyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Cc1cc(C)n2c(n1)nc(n2)C(=O)NCCC1=CCCCC1

STK597745
Synonyms: N'-[(Z)-(1-cycloheptyl-2-hydroxy-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]heptanehydrazide
Smiles: CCCCCCC(=O)NN/C=C\1/C(=O)N=C(N(C1=O)C1CCCCCC1)O

STK597746
Synonyms: N-[(2Z)-5,5-dioxido-3-[2-(trifluoromethyl)phenyl]tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=C/1\SC2C(N1c1ccccc1C(F)(F)F)CS(=O)(=O)C2

STK597747
Synonyms: (2E)-1-(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)-3-(4-fluorophenyl)prop-2-en-1-one
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)/C=C/c1ccc(cc1)F

STK597748
Synonyms: N-(2-methoxyphenyl)-4-methyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: COc1ccccc1N(S(=O)(=O)c1ccc(cc1)C)Cc1cc2cccc(c2[nH]c1=O)C

STK597751
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-3-(2,3-dimethoxyphenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: COc1c(OC)cccc1C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)NC2=O

STK597752
Synonyms: N-(2-tert-butylphenyl)-2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1COc1ccc(cc1)Cl

STK597753
Synonyms: 2-(morpholin-4-ium-4-yl)-5-[(3,4,5-trimethoxybenzyl)amino]benzoate
Smiles: COc1cc(CNc2ccc(c(c2)C(=O)[O-])[NH+]2CCOCC2)cc(c1OC)OC

STK597755
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(4-chlorophenyl)carbonyl]-3'-[(2-propoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCOc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)Cl)C(=O)Nc1c2cccc1)cccc3

STK597756
Synonyms: (2S)-N-(3,4-dimethoxyphenyl)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: COc1cc(ccc1OC)NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C(C)C

STK597757
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(4-pentylphenyl)carbonyl]-3'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccs2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK597758
Synonyms: methylN-[(2,4-dimethylphenyl)carbamoyl]-L-methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)Nc1ccc(cc1C)C

STK597760
Synonyms: 3-(2-bromophenoxy)-2-methyl-4-oxo-8-(pyrrolidinium-1-ylmethyl)-4H-chromen-7-olate
Smiles: Cc1oc2c(C[NH+]3CCCC3)c([O-])ccc2c(=O)c1Oc1ccccc1Br

STK597762
Synonyms: 4-chloro-N-[(2E)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]-3-nitrobenzamide
Smiles: O=C(c1ccc(c(c1)[N+](=O)[O-])Cl)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)C

STK597763
Synonyms: (4Z)-2-(thiophen-2-yl)-4-[2-(thiophen-2-yl)-4H-chromen-4-ylidene]-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\1/C=C(Oc2c1cccc2)c1cccs1)c1cccs1

STK597764
Synonyms: 1-(2-methoxyphenyl)-2,7-dimethyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccccc1C1N(C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK597766
Synonyms: 2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK597768
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-7-(2-ethyl-1H-imidazol-1-yl)pyrazolo[1,5-a]pyrimidine
Smiles: CCc1nccn1c1cc(nc2n1ncc2c1ccc(cc1)Cl)C(C)(C)C

STK597769
Synonyms: 2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)OC)nnc1c1ccccc1Cl

STK597770
Synonyms: N-(2-methoxyethyl)-4-methyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: COCCN(S(=O)(=O)c1ccc(cc1)C)Cc1cc2ccccc2[nH]c1=O

STK597771
Synonyms: (3a'S,6a'R)-5-fluoro-3'-(1H-indol-3-ylmethyl)-5'-(3-methoxyphenyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(F)cc2

STK597772
Synonyms: 2,2-dimethyl-5-(propan-2-yl)-8-(pyrrolidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC(c1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCCC1)C

STK597773
Synonyms: 2-{[10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1cccc(c1)OC)nn2)CC(OC3)(C)C

STK597774
Synonyms: 2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-ethylphenyl)acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK597775
Synonyms: 5-[3-(benzyloxy)phenyl]-N'-[(E)-thiophen-2-ylmethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1)N/N=C/c1cccs1

STK597776
Synonyms: 1-(4-methoxyphenyl)-7-methyl-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK597779
Synonyms: N-[(2Z)-3-(2-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenoxyacetamide
Smiles: COc1ccccc1N1/C(=N/C(=O)COc2ccccc2)/SC2C1CS(=O)(=O)C2

STK597780
Synonyms: N-(3-oxo-3-{[3-(1H-tetrazol-1-yl)phenyl]amino}propyl)benzamide
Smiles: O=C(Nc1cccc(c1)n1cnnn1)CCNC(=O)c1ccccc1

STK597781
Synonyms: 5-(2-methoxyphenyl)-4-{[(E)-(2-methylphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccccc1C

STK597783
Synonyms: 2-{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2-ethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2CC)N=C2C(=C(O)CCC2)C1c1ccc(cc1)Cl

STK597784
Synonyms: (4E)-1-(furan-2-ylmethyl)-4-[hydroxy(3-nitrophenyl)methylidene]-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: Oc1ccc(cc1)C1/C(=C(/c2cccc(c2)[N+](=O)[O-])\O)/C(=O)C(=O)N1Cc1ccco1

STK597785
Synonyms: methyl3-[(9-fluoro-5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)methyl]-4-methoxybenzoate
Smiles: COC(=O)c1ccc(c(c1)Cn1c2ccc(cc2c2c1c(=O)n1CCSc1n2)F)OC

STK597786
Synonyms: 10-methoxy-7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-6(7H)-one
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2CC(=O)N1CCC(CC1)C

STK597787
Synonyms: 3-benzyl-1,6,7-trimethyl-8-(tetrahydrofuran-2-ylmethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cn1c(=O)n(Cc2ccccc2)c(=O)c2c1nc1n2c(c(n1CC1CCCO1)C)C

STK597788
Synonyms: N-(2-fluorophenyl)-2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2F)nnc1Cc1cccs1

STK597790
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-{[4-ethyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(c(c2)C(F)(F)F)Cl)nnc1c1cccc(c1)C

STK597791
Synonyms: N-(furan-2-ylmethyl)-2-methyl-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]propanamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)C(C)C)Cc1ccco1

STK597793
Synonyms: 6,7-dimethoxy-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CCN(Cc2cc1OC)S(=O)(=O)c1ccc2c(c1)CCCC2

STK597797
Synonyms: 4-butyl-6-chloro-2-oxo-2H-chromen-7-ylN-[(4-methylphenyl)sulfonyl]-beta-alaninate
Smiles: CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)CCNS(=O)(=O)c1ccc(cc1)C

STK597798
Synonyms: 6-chloro-3,4-dimethyl-9-(3,4,5-trimethoxyphenyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: COc1cc(cc(c1OC)OC)N1COc2c(C1)c1oc(=O)c(c(c1cc2Cl)C)C

STK597799
Synonyms: (1S)-1-[5-(benzylsulfanyl)-1,3,4-oxadiazol-2-yl]-3-methylbutan-1-amine
Smiles: N[C@H](c1nnc(o1)SCc1ccccc1)CC(C)C

STK597801
Synonyms: (3S)-N-[(2S)-3-methyl-1-oxo-1-{[4-(propan-2-yl)phenyl]amino}butan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: CC([C@@H](C(=O)Nc1ccc(cc1)C(C)C)NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK597802
Synonyms: 3-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-[(2-methylprop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-4-amine
Smiles: CC(=C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK597804
Synonyms: N-[4-(4-chlorophenyl)-6-methyl-2-(4-methylphenyl)-5-oxo-2,5-dihydropyridazin-3-yl]-4-nitrobenzamide
Smiles: Cc1ccc(cc1)n1nc(C)c(=O)c(c1NC(=O)c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)Cl

STK597805
Synonyms: (E)-{1-[4-(dimethylammonio)phenyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Smiles: Cc1ccc(cc1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)c1ccc(cc1)[NH+](C)C)/[O-]

STK597806
Synonyms: 4-[(4-benzylpiperidinium-1-yl)methyl]-8-methyl-2-oxo-2H-chromen-7-olate
Smiles: O=c1cc(C[NH+]2CCC(CC2)Cc2ccccc2)c2c(o1)c(C)c(cc2)[O-]

STK597807
Synonyms: N-(2,3-dihydroimidazo[2,1-b][1,3]benzothiazol-6-yl)-6-methoxy-1H-indole-2-carboxamide
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)Nc1ccc2c(c1)n1CCN=c1s2

STK597808
Synonyms: 7-fluoro-1-(3-fluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK597809
Synonyms: N-[2-(dimethylamino)ethyl]-3-(furan-2-yl)nonanamide
Smiles: CCCCCCC(c1ccco1)CC(=O)NCCN(C)C

STK597810
Synonyms: 6-hydroxy-3-methyl-7-(4-methylbenzyl)-8-(prop-2-en-1-ylsulfanyl)-3,7-dihydro-2H-purin-2-one
Smiles: C=CCSc1nc2c(n1Cc1ccc(cc1)C)c(O)nc(=O)n2C

STK597811
Synonyms: 2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK597813
Synonyms: 7'-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trio
Smiles: C=CCN1C(=NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)S

STK597814
Synonyms: 3-butyl-2-cyclohexyl-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)C1CCCCC1

STK597815
Synonyms: N-(3,4-difluorophenyl)-6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)hexanamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CCCCCn1nnc2c(c1=O)cccc2

STK597816
Synonyms: 8-[(furan-2-ylmethyl)amino]-6-hydroxy-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COc1ccc(cc1)CCn1c(NCc2ccco2)nc2c1c(O)nc(=O)n2C

STK597817
Synonyms: N-[4-(dimethylamino)phenyl]-2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)N(C)C)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK597819
Synonyms: (4E)-1-(3-chloro-4-methylphenyl)-4-[hydroxy(phenyl)methylidene]-5-(2-nitrophenyl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccccc1[N+](=O)[O-])c1ccc(c(c1)Cl)C)/c1ccccc1

STK597821
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-3-(4-chlorophenyl)-5,7-dioxo-3a,4,4a,5,7,7a,8,8a-octahydro-6H-4,8-methano[1,2]oxazolo[4,5-f]isoindole-6-carboxamide
Smiles: Clc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)C(=O)N

STK597822
Synonyms: 6-(2,4-dimethoxyphenyl)-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(c(c1)OC)C1CC(=C2C(=Nc3n(C2c2ccccc2)ncn3)C1)O

STK597823
Synonyms: (4E)-1-butyl-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1ccc(cc1)[N+](=O)[O-]

STK597825
Synonyms: 1-(2-chlorophenyl)-6-cyclopentyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(S)n(c2c1CN(CN2)C1CCCC1)c1ccccc1Cl

STK597827
Synonyms: 5-{4-[(4-chlorobenzyl)oxy]phenyl}-N'-[(E)-(4-methylphenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: Cc1ccc(cc1)/C=N/NC(=O)c1n[nH]c(c1)c1ccc(cc1)OCc1ccc(cc1)Cl

STK597828
Synonyms: 7-benzyl-1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCCCN1Cc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C