COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION
FULL DB
Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )
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STK570388
Synonyms: 6-(4-benzylpiperazin-1-yl)-N~2~-(3-methylbutyl)-5-nitropyrimidine-2,4-diamine
Smiles: CC(CCNc1nc(N2CCN(CC2)Cc2ccccc2)c(c(n1)N)[N+](=O)[O-])C
STK570389
Synonyms: (E)-{2-(4-butoxy-3-methoxyphenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: CCCCOc1ccc(cc1OC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1
STK570390
Synonyms: 2-methyl-4-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}[1]benzofuro[3,2-d]pyrimidine
Smiles: Cc1nc(N2CCN(CC2)C/C=C/c2ccccc2)c2c(n1)c1ccccc1o2
STK570391
Synonyms: (4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)Cl
STK570392
Synonyms: (5Z)-5-(3-nitrobenzylidene)-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C\c1cccc(c1)[N+](=O)[O-])N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]
STK570393
Synonyms: (E)-[2-(4-methylphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene][4-(2-methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C)Cc1ccc[nH+]c1)/[O-])C
STK570394
Synonyms: N-[(3Z)-6-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]cyclohexanecarboxamide
Smiles: CCCn1[nH]/c(=N\C(=O)C2CCCCC2)/c2c1nc1ccc(cc1c2)C
STK570395
Synonyms: (E)-{2-[4-(benzyloxy)-3-ethoxyphenyl]-1-[3-(diethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+](CC)CC
STK570396
Synonyms: 4-tert-butyl-N-[(3Z)-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: CC(Cn1[nH]/c(=N\C(=O)c2ccc(cc2)C(C)(C)C)/c2c1nc1ccccc1c2)C
STK570397
Synonyms: (E)-{1-[3-(dimethylammonio)propyl]-2-(2-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(2-methylpropoxy)phenyl]methanolate
Smiles: CCOc1ccccc1C1/C(=C(/c2ccc(cc2)OCC(C)C)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C
STK570399
Synonyms: N-butyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]thiophene-2-carboxamide
Smiles: CCCCN(C(=O)c1cccs1)Cc1cc2ccccc2[nH]c1=O
STK570400
Synonyms: 2-[(1E)-1-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]phenolate
Smiles: Clc1ccc(cc1)SCc1c(nnn1c1nonc1[NH3+])C(=O)N/N=C(/c1ccccc1[O-])\C
STK570401
Synonyms: (4E)-5-(3-butoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C
STK570402
Synonyms: 4-{[2'-(3,4-dimethoxyphenyl)-1,3-dioxo-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinolin]-1'-yl]carbonyl}phenylacetate
Smiles: COc1ccc(cc1OC)C1C(C(=O)c2ccc(cc2)OC(=O)C)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STK570403
Synonyms: N-[(2Z)-3-[(4-methoxyphenyl)amino]quinoxalin-2(1H)-ylidene]-3,4-dimethylbenzenesulfonamide
Smiles: COc1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(c(c1)C)C
STK570404
Synonyms: 3-(4-chlorophenyl)-5-(2-methoxy-5-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1ccc(cc1N1C(=O)C2C(C1=O)C(=NO2)c1ccc(cc1)Cl)[N+](=O)[O-]
STK570405
Synonyms: (4E)-5-(2,5-dimethoxyphenyl)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1cc(OC)ccc1OC
STK570407
Synonyms: (5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-1-phenyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: SC1=NC(=O)/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C(=O)N1c1ccccc1
STK570410
Synonyms: (5E)-6-hydroxy-3-(4-methylphenyl)-5-{1-[(2-phenylethyl)amino]ethylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C(\NCCc2ccccc2)/C)/C1=O)O
STK570413
Synonyms: N-(4-{[(1E)-1-(1-butyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)ethyl]amino}phenyl)acetamide
Smiles: CCCCN1C(=O)N=C(/C(=C(\Nc2ccc(cc2)NC(=O)C)/C)/C1=O)O
STK570414
Synonyms: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: C=CCOc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)OCC)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O
STK570415
Synonyms: 1-(4-bromophenyl)-1',6'-dimethyl-2,6-dioxo-1,1',4',6-tetrahydro-2H,2'H-spiro[pyrimidine-5,3'-quinolinium]-4-olate
Smiles: Brc1ccc(cc1)N1C(=O)N=C(C2(C1=O)C[NH+](C)c1c(C2)cc(cc1)C)[O-]
STK570416
Synonyms: N-[(2Z)-3-[(3,4-dichlorophenyl)amino]quinoxalin-2(1H)-ylidene]-4-fluorobenzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(c(c1)Cl)Cl
STK570417
Synonyms: (E)-{2-(3-butoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1
STK570418
Synonyms: 10-[(4-bromophenyl)carbonyl]-2-chloro-8-(2-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccccc1N1C(=O)C2C(C1=O)C(N1C2C=Cc2c1cc(cc2)Cl)C(=O)c1ccc(cc1)Br
STK570420
Synonyms: (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: C=CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O
STK570421
Synonyms: 1-(biphenyl-4-yl)-2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Smiles: Cc1ccc(cc1)OCc1nnc(n1Cc1ccco1)SCC(=O)c1ccc(cc1)c1ccccc1
STK570423
Synonyms: (3'E)-3'-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1'-(2-methoxyethyl)-1-methylspiro[indole-3,2'-pyrrolidine]-2,4',5'(1H)-trione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C21C(=O)N(c1c2cccc1)C
STK570425
Synonyms: (5Z)-1-(4-fluorophenyl)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)F)C)/C1=O)S
STK570427
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-sulfamoylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1COc1ccc(cc1)Cl
STK570428
Synonyms: 3-(furan-2-yl)-4-phenyl-N-[4-(propan-2-yloxy)benzyl]butan-1-amine
Smiles: CC(Oc1ccc(cc1)CNCCC(c1ccco1)Cc1ccccc1)C
STK570429
Synonyms: 5-chloro-2'-(2-fluorophenyl)-7-methyl-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)C1(C(=O)N2)N2CCCC2C2C1C(=O)N(C2=O)c1ccccc1F
STK570432
Synonyms: 7-ethyl-2'-(2-methoxy-4-nitrophenyl)-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: COc1cc(ccc1N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cccc2CC)[N+](=O)[O-]
STK570433
Synonyms: (4E)-1-benzyl-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(2-fluorophenyl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccccc1F)Cc1ccccc1)/c1ccc2c(c1)OCCO2
STK570434
Synonyms: (1'S,2'S,3R,3a'R)-2'-[(4-fluorophenyl)carbonyl]-5'-methyl-1'-[(4-nitrophenyl)carbonyl]-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)c2ccc(cc2)[N+](=O)[O-])N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=C(c1c2cccc1)C
STK570435
Synonyms: (4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)Cl
STK570436
Synonyms: 3,3-dimethyl-8-(piperazin-1-yl)-6-thioxo-3,4,6,7-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(=S)[nH]c(c2c1CC(C)(C)OC2)N1CCNCC1
STK570438
Synonyms: (6Z)-5-imino-6-{4-[(2-nitrobenzyl)oxy]benzylidene}-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C/c1ccc(cc1)OCc1ccccc1[N+](=O)[O-])c1cccnc1
STK570440
Synonyms: 3-[5-(4-bromophenyl)furan-2-yl]-5-(naphthalen-1-yl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Brc1ccc(cc1)c1ccc(o1)C1N(OC2C1C(=O)N(C2=O)c1cccc2c1cccc2)c1ccccc1
STK570441
Synonyms: (2Z)-2-[(4-chlorophenyl)imino]-5-nitro-6-(pyrrolidin-1-yl)-1,2-dihydropyrimidin-4-amine
Smiles: Clc1ccc(cc1)/N=c/1\nc(N)c(c([nH]1)N1CCCC1)[N+](=O)[O-]
STK570442
Synonyms: 3-(4-tert-butylphenyl)-5-[(4-methylbenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Smiles: C=CCn1c(nnc1c1ccc(cc1)C(C)(C)C)SCc1ccc(cc1)C
STK570444
Synonyms: 4-[(E)-{(2E)-[4-(2,4-dichlorophenyl)-1,3-thiazol-2(3H)-ylidene]hydrazinylidene}methyl]-2-methoxyphenyl4-tert-butylbenzoate
Smiles: COc1cc(/C=N/N=c\2/scc([nH]2)c2ccc(cc2Cl)Cl)ccc1OC(=O)c1ccc(cc1)C(C)(C)C
STK570445
Synonyms: 7-bromo-2-(4-methyl-1,3-thiazol-2-yl)-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Brc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1scc(n1)C
STK570446
Synonyms: 2-[5-(3-chlorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenylbenzenesulfonate
Smiles: Clc1cccc(c1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccccc1OS(=O)(=O)c1ccccc1
STK570447
Synonyms: (4E)-5-(4-fluorophenyl)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(c2ccc(cc2)F)/C(=C(/c2ccc(cc2)OC(C)C)\O)/C(=O)C1=O
STK570448
Synonyms: (4E)-5-(4-fluorophenyl)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(thiophen-2-yl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(c2ccc(cc2)F)/C(=C(/c2cccs2)\O)/C(=O)C1=O
STK570449
Synonyms: 2-(4-nitro-1H-pyrazol-1-yl)-N'-{(1E)-1-[4-(1H-pyrrol-1-yl)phenyl]ethylidene}acetohydrazide
Smiles: C/C(=N\NC(=O)Cn1ncc(c1)[N+](=O)[O-])/c1ccc(cc1)n1cccc1
STK570450
Synonyms: 5-(3-ethoxyphenyl)-4-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)OC)O
STK570451
Synonyms: methyl5-({4-[(E)-{2-[(4-{[(4-tert-butylphenyl)carbonyl]amino}phenyl)carbonyl]hydrazinylidene}methyl]-2-ethoxyphenoxy}methyl)furan-2-carboxylate
Smiles: CCOc1cc(/C=N/NC(=O)c2ccc(cc2)NC(=O)c2ccc(cc2)C(C)(C)C)ccc1OCc1ccc(o1)C(=O)OC
STK570453
Synonyms: (2-{(E)-[2-({[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetate
Smiles: O=C(CSc1[nH+]nc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)N/N=C/c1ccccc1OCC(=O)[O-]
STK570454
Synonyms: (4E)-1-[3-(dimethylamino)propyl]-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1CCCN(C)C
STK570457
Synonyms: N-(3-bromophenyl)-N'-[(2E)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
Smiles: CC(Cc1n[nH]/c(=N\C(=O)CCC(=O)Nc2cccc(c2)Br)/s1)C
STK570458
Synonyms: N-(2-ethoxyphenyl)-2-{[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1cccc(c1)OC
STK570459
Synonyms: (5Z)-6-hydroxy-3-(4-methoxyphenyl)-5-{[(2-methylbutyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: CCC(CN/C=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)C
STK570460
Synonyms: 2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C(F)(F)F)Cl)nnc1c1ccccc1Cl
STK570461
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(E)-(4-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)[N+](=O)[O-]
STK570462
Synonyms: methyl2-{(3E)-2-[4-(benzyloxy)-3-ethoxyphenyl]-3-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OC
STK570463
Synonyms: 11-(5-bromofuran-2-yl)-10-methyl-N-(3-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Brc1ccc(o1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)C)c1ccccc1
STK570464
Synonyms: 1,1'-benzene-1,2-diylbis{3-chloro-4-[(4-methoxyphenyl)amino]-1H-pyrrole-2,5-dione}
Smiles: COc1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)c1ccccc1N1C(=O)C(=C(C1=O)Nc1ccc(cc1)OC)Cl
STK570465
Synonyms: 2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)C)nnc1c1cccc(c1)Cl
STK570466
Synonyms: 3-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1cccc(c1)[N+](=O)[O-])c1ccc(cc1Cl)Cl
STK570467
Synonyms: 4-(4-methylphenyl)-N-phenyl-1-[4-(propan-2-yl)phenyl]-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1)c1ccc(cc1)C(C)C
STK570469
Synonyms: ethyl2-(3,4-dimethoxyphenyl)-4-hydroxy-1-(4-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)C1=C(O)C(=O)N(C1c1ccc(c(c1)OC)OC)c1ccc(cc1)[N+](=O)[O-]
STK570470
Synonyms: 4-[(E)-{(2E)-[7-(4-fluorobenzyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6,7,9-hexahydro-8H-purin-8-ylidene]hydrazinylidene}methyl]phenylfuran-2-carboxylate
Smiles: Fc1ccc(cc1)Cn1/c(=N/N=C/c2ccc(cc2)OC(=O)c2ccco2)/[nH]c2c1c(=O)n(c(=O)n2C)C
STK570472
Synonyms: (4E)-4-[hydroxy(naphthalen-2-yl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(4-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)cccc3)\O)/C(=O)C(=O)N1c1noc(c1)C
STK570473
Synonyms: (E)-{2-(3-chlorophenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: Clc1cccc(c1)C1N(CCCn2c[nH+]cc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/[O-]
STK570474
Synonyms: (4E)-5-(2,4-dimethoxyphenyl)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1ccc(cc1OC)OC
STK570475
Synonyms: 2-(4-methoxyphenyl)-3-{4-[2-(propan-2-yloxy)phenoxy]butyl}quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccccc1OC(C)C
STK570478
Synonyms: N-[(2Z)-3-[(4-fluorobenzyl)amino]quinoxalin-2(1H)-ylidene]-2,5-dimethylbenzenesulfonamide
Smiles: Fc1ccc(cc1)CNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cc(C)ccc1C
STK570481
Synonyms: (1'S,2'S,3R,3a'R)-1'-acetyl-5',7'-dimethyl-2'-[(3-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Cc1ccc2c(c1)C(=C[C@H]1N2[C@H](C(=O)C)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccc(c1)[N+](=O)[O-])C
STK570482
Synonyms: N-[(3Z)-1-ethyl-7-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-2,2-dimethylpropanamide
Smiles: CCn1[nH]/c(=N\C(=O)C(C)(C)C)/c2c1nc1cc(C)ccc1c2
STK570483
Synonyms: (2Z)-N~6~-(2,5-dimethoxyphenyl)-2-[(2,5-dimethoxyphenyl)imino]-5-nitro-1,2-dihydropyrimidine-4,6-diamine
Smiles: COc1ccc(c(c1)Nc1[nH]/c(=N/c2cc(OC)ccc2OC)/nc(c1[N+](=O)[O-])N)OC
STK570484
Synonyms: (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(cc1)C
STK570485
Synonyms: 6-(4-methoxyphenyl)-2-methyl-7-(pyridin-3-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1)C1Oc2ccc(cc2C2=C1C(c1cccnc1)n1c(N2)ncn1)C
STK570486
Synonyms: N-[(3Z)-1,6-dimethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]acetamide
Smiles: Cc1ccc2c(c1)cc1c(n2)n([nH]/c/1=N\C(=O)C)C
STK570488
Synonyms: N-[(2Z)-3-[(4-ethoxyphenyl)amino]quinoxalin-2(1H)-ylidene]-3,4-dimethylbenzenesulfonamide
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(c(c1)C)C
STK570490
Synonyms: N-[(3Z)-6-methyl-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]pentanamide
Smiles: CCCCC(=O)/N=c/1\[nH]n(c2c1cc1cc(C)ccc1n2)CC(C)C
STK570492
Synonyms: 3-{4-[(1-bromonaphthalen-2-yl)oxy]butyl}-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccc2c(c1Br)cccc2
STK570493
Synonyms: (5E)-1-benzyl-5-(1-{[3-(dimethylammonio)propyl]amino}propylidene)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)[O-])/NCCC[NH+](C)C
STK570496
Synonyms: 7'-chloro-1'-(2,2-dimethylpropanoyl)-2'-[4-(trifluoromethyl)phenyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc2c(c1)C=CC1N2C(C(=O)C(C)(C)C)C(C21C(=O)c1c(C2=O)cccc1)c1ccc(cc1)C(F)(F)F
STK570497
Synonyms: 4-[(Z)-{2-[4-(3-chlorophenyl)piperazin-4-ium-1-yl]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]-2-ethoxyphenolate
Smiles: CCOc1cc(ccc1[O-])/C=C/1\SC(=NC1=O)N1CC[NH+](CC1)c1cccc(c1)Cl
STK570498
Synonyms: 2-chloro-N-[(3Z)-8-methyl-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: CC(Cn1[nH]/c(=N\C(=O)c2ccccc2Cl)/c2c1nc1c(c2)cccc1C)C
STK570499
Synonyms: 5-chloro-7-methyl-2'-(naphthalen-2-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)C1(C(=O)N2)N2CCCC2C2C1C(=O)N(C2=O)c1ccc2c(c1)cccc2
STK570500
Synonyms: methyl[(5Z)-5-{[(4-fluorophenyl)carbonyl]imino}-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetate
Smiles: COC(=O)Cc1n[nH]/c(=N/C(=O)c2ccc(cc2)F)/s1
STK570502
Synonyms: ethyl5-acetyl-2-({(Z)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2cccc(c2)[N+](=O)[O-])/C#N)sc(c1C)C(=O)C
STK570503
Synonyms: 7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-8-[benzyl(methyl)amino]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CN(c1nc2c(n1CCSc1nc3c(s1)cccc3)c(O)nc(=O)n2C)Cc1ccccc1
STK570504
Synonyms: N-(2,4-dimethoxyphenyl)-2-({5-[(4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2OC)OC)nnc1COc1ccc(cc1)C
STK570506
Synonyms: N-[(2E)-3-cyano-5-oxo-1-(propan-2-yl)-1,5-dihydro-2H-pyrido[1,2-g][1,6]naphthyridin-2-ylidene]-2-methyl-3-nitrobenzamide
Smiles: N#Cc1cc2c(n(/c/1=N/C(=O)c1cccc(c1C)[N+](=O)[O-])C(C)C)cc1n(c2=O)cccc1
STK570507
Synonyms: (5Z)-3-butyl-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCCCN1C(=O)N=C(/C(=C/c2cc(n(c2C)c2ccc(cc2)F)C)/C1=O)O
STK570508
Synonyms: 2-({5-[(1S)-1-amino-2-methylpropyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(2,6-dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(o1)[C@H](C(C)C)N
STK570509
Synonyms: N'-[(1E)-1-(4-bromophenyl)ethylidene]-2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Br)N/N=C(/c1ccc(cc1)Br)\C
STK570510
Synonyms: (1'S,2'S,3R,3a'R)-2'-[(2,5-dimethoxyphenyl)carbonyl]-5'-methyl-1'-[(4-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)[N+](=O)[O-])N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=C(c1c2cccc1)C)OC
STK570511
Synonyms: (4E)-5-(4-hydroxy-3-methoxyphenyl)-4-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-1-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1O)C1N(c2ccc(cc2)OC)C(=O)C(=O)/C/1=C(\C=C\c1ccccc1)/O
STK570512
Synonyms: 4-[(3-{(2Z)-2-[(2E)-(2-chloro-6-fluorobenzylidene)hydrazinylidene]-2,3-dihydro-1,3-thiazol-4-yl}phenyl)sulfonyl]morpholine
Smiles: Fc1cccc(c1/C=N/N=c/1\scc([nH]1)c1cccc(c1)S(=O)(=O)N1CCOCC1)Cl
STK570513
Synonyms: N-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)acetamide
Smiles: CC(=O)NC1(C)CCS(=O)(=O)C1
STK570514
Synonyms: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-3-(1,3-benzodioxol-5-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2nc3c([nH]2)cccc3)/C(=O)N1c1ccc2c(c1)OCO2
STK570515
Synonyms: (E)-{2-(3,4-dimethoxyphenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: COc1cc(ccc1OC)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/[O-]
STK570516
Synonyms: (1'R,2'R)-2'-(4-chlorophenyl)-1'-[(4-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccc(cc2)[N+](=O)[O-])N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
STK570517
Synonyms: 2-{[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl}acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)Nc1cc(C)nc(n1)C)CSc1nnc(n1c1ccccc1)c1ccccc1Cl
STK570518
Synonyms: N-[(2Z)-3-[(2-chlorobenzyl)amino]quinoxalin-2(1H)-ylidene]-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NCc1ccccc1Cl
STK570519
Synonyms: N-[(3Z)-1-butyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]pyridine-2-carboxamide
Smiles: CCCCn1[nH]/c(=N\C(=O)c2ccccn2)/c2c1nc1ccccc1c2
STK570520
Synonyms: (4E)-5-(4-butoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
STK570521
Synonyms: 2'-(1,3-benzodioxol-5-ylcarbonyl)-1'-[(2-fluorophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Fc1ccccc1C(=O)C1N2c3ccccc3C=CC2C2(C1C(=O)c1ccc3c(c1)OCO3)C(=O)Nc1c2cccc1
STK570522
Synonyms: N-cyclohexyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-4-nitrobenzamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1ccc(cc1)[N+](=O)[O-])C1CCCCC1
STK570523
Synonyms: (4E)-5-(3-butoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: CCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCOC
STK570525
Synonyms: N-[7-(4-chlorophenyl)-5-oxo-3,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1nn2c(=NC(=O)CC2c2ccc(cc2)Cl)[nH]1
STK570526
Synonyms: 2-hydroxy-4-[(E)-{5-iminio-2-[2-(morpholin-4-yl)-2-oxoethyl]-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene}methyl]phenolate
Smiles: O=C(N1CCOCC1)Cc1nn2c(=NC(=O)/C(=C/c3ccc(c(c3)O)[O-])/C2=[NH2+])s1
STK570527
Synonyms: N-[(3E)-6-methoxy-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-3-methylbenzamide
Smiles: CCCn1[nH]/c(=N/C(=O)c2cccc(c2)C)/c2c1nc1ccc(cc1c2)OC
STK570530
Synonyms: 2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)C)N/N=C/c1ccc(cc1O)O
STK570532
Synonyms: (E)-{2-(2,3-dimethoxyphenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1OC)OC)CC[NH+](C)C)/[O-]
STK570533
Synonyms: 5-(methylsulfanyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e]imidazo[1,2-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2=NCCn12)CCCC3
STK570534
Synonyms: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenolate
Smiles: [O-]c1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1[NH3+]
STK570536
Synonyms: 2-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(2,4,6-tribromophenyl)acetamide
Smiles: O=C(Nc1c(Br)cc(cc1Br)Br)CSc1ncnc2c1cnn2c1ccc(cc1)Cl
STK570537
Synonyms: N'-[(1E)-1-(naphthalen-1-yl)ethylidene]-2-(4-nitro-1H-pyrazol-1-yl)acetohydrazide
Smiles: O=C(Cn1ncc(c1)[N+](=O)[O-])N/N=C(/c1cccc2c1cccc2)\C
STK570538
Synonyms: (5Z)-1-(2-methoxyphenyl)-2,6-dioxo-5-{[2-(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-9-ium-8-yl)hydrazinyl]methylidene}-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C/NNc2[nH+]c3c(n2C)c(=O)n(c(=O)n3C)C)/C1=O)[O-]
STK570540
Synonyms: (5Z)-1-(3-methylphenyl)-2,6-dioxo-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolinium-9-ylmethylidene)-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: Cc1cccc(c1)N1C(=O)N=C(/C(=C/c2cc3CCC[NH+]4c3c(c2)CCC4)/C1=O)[O-]
STK570541
Synonyms: 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N'-[(E)-(5-methylfuran-2-yl)methylidene]acetohydrazide
Smiles: O=C(Cn1nc(c(c1C)[N+](=O)[O-])C)N/N=C/c1ccc(o1)C
STK570543
Synonyms: N-[3,5-bis(trifluoromethyl)phenyl]-2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl
STK570544
Synonyms: 3-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylammonio)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}phenolate
Smiles: C[NH+](Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)[O-])C
STK570545
Synonyms: 4-{[(E)-(2-methoxynaphthalen-1-yl)methylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc2c(c1/C=N/n1c(S)nnc1c1n[nH]c(c1)C)cccc2
STK570546
Synonyms: 2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
Smiles: Clc1ccc(cc1)n1c(SCC(=O)c2ccccc2)nnc1c1ccccc1Cl
STK570547
Synonyms: 2-[4-(benzyloxy)-3-methoxyphenyl]-5-(4'-nitrobiphenyl-4-yl)-4-phenyl-1H-imidazole
Smiles: COc1cc(ccc1OCc1ccccc1)c1nc(c([nH]1)c1ccc(cc1)c1ccc(cc1)[N+](=O)[O-])c1ccccc1
STK570549
Synonyms: N-[(2Z)-3-[(4-phenoxyphenyl)amino]quinoxalin-2(1H)-ylidene]thiophene-2-sulfonamide
Smiles: O=S(=O)(c1cccs1)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(cc1)Oc1ccccc1
STK570550
Synonyms: (4E)-5-(3-butoxyphenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)Cl
STK570551
Synonyms: 4-[4-(2-methoxyphenyl)piperazin-1-yl]-4-oxo-N-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)c2ccccc2OC)/s1
STK570553
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-nitrophenyl)methylidene]-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]
STK570554
Synonyms: N-[(2Z)-3-[(1,3-benzodioxol-5-ylmethyl)amino]quinoxalin-2(1H)-ylidene]-3,4-dimethylbenzenesulfonamide
Smiles: Cc1ccc(cc1C)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NCc1ccc2c(c1)OCO2
STK570557
Synonyms: methyl2-[(3E)-3-[(4-butoxy-3-methylphenyl)(hydroxy)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCCCOc1ccc(cc1C)/C(=C\1/C(c2ccc(cc2)C)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)/O
STK570558
Synonyms: (5E)-5-{[(1-benzylpiperidinium-4-yl)amino]methylidene}-1-(4-fluorobenzyl)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: Fc1ccc(cc1)CN1C(=O)N=C(/C(=C\NC2CC[NH+](CC2)Cc2ccccc2)/C1=O)[O-]
STK570561
Synonyms: 11-(5-bromofuran-2-yl)-N-(3,5-dimethylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1cc(cc(c1)C)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(o2)Br)c(nn1c1ccccc1)C
STK570562
Synonyms: 6-amino-3-[4-(benzyloxy)phenyl]-4-(2-chlorophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1Cl)c([nH]n2)c1ccc(cc1)OCc1ccccc1
STK570565
Synonyms: N-[4-({(1E)-1-[4-hydroxy-1-(4-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]ethyl}amino)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N/C(=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/C
STK570568
Synonyms: 6-methyl-4-oxo-8-(pyrrolidinium-1-ylmethyl)-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-olate
Smiles: [O-]c1c(C[NH+]2CCCC2)cc2c(c1C)oc(=O)c1c2CCC1
STK570569
Synonyms: (3S,3a'R,8a'S,8b'S)-5-chloro-2'-(2-methoxy-5-nitrophenyl)-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: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2)[N+](=O)[O-]
STK570571
Synonyms: 3-(4-bromophenyl)-8-[(4-ethylpiperazin-1-ium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)c1ccc(cc1)Br
STK570572
Synonyms: 2'-(2,4-dichlorophenyl)-1'-[(3-methoxyphenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)C1N2c3ccc(cc3C=CC2C2(C1c1ccc(cc1Cl)Cl)C(=O)c1c(C2=O)cccc1)C
STK570574
Synonyms: (4E)-5-(4-tert-butylphenyl)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(thiophen-2-yl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2cccs2)/O)/C1c1ccc(cc1)C(C)(C)C
STK570575
Synonyms: methylN-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-L-phenylalaninate
Smiles: COC(=O)[C@@H](NC(=O)N1CCN(CC1)c1ccc(cc1)F)Cc1ccccc1
STK570576
Synonyms: 3-(3-bromo-4-methoxyphenyl)-5-(4-butoxyphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCCCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(c(c1)Br)OC
STK570577
Synonyms: (4E)-1-benzyl-5-(3-chlorophenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: Clc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1
STK570578
Synonyms: (4E)-5-[4-(benzyloxy)-3-ethoxyphenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
STK570579
Synonyms: (E)-{2-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/[O-])/C1c1cc(Br)c(c(c1)OC)O)CC
STK570580
Synonyms: (5Z)-2,6-dihydroxy-5-{1-[(3-hydroxypropyl)amino]ethylidene}pyrimidin-4(5H)-one
Smiles: OCCCN/C(=C\1/C(=NC(=NC1=O)O)O)/C
STK570581
Synonyms: N-(2-tert-butylphenyl)-2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1c1cccc(c1)Cl
STK570582
Synonyms: N-[(2Z)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-4-(4-phenylpiperazin-1-yl)butanamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C1CCCCC1)CCC(=O)N1CCN(CC1)c1ccccc1
STK570583
Synonyms: (E)-[2-(2,5-dimethoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cc(OC)ccc1OC)Cc1ccc[nH+]c1)/[O-]
STK570584
Synonyms: (4E)-4-[hydroxy(4-nitrophenyl)methylidene]-5-(4-methoxyphenyl)-1-phenylpyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C(=O)N1c1ccccc1
STK570585
Synonyms: N-(4-butylphenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)COc1ccc(cc1)C
STK570586
Synonyms: 7'-chloro-2'-(2,3-dimethoxyphenyl)-1'-(2,2-dimethylpropanoyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1OC)C1C(N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl)C(=O)C(C)(C)C
STK570587
Synonyms: N'-{(E)-[3-(benzyloxy)-4-methoxyphenyl]methylidene}-2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1OCc1ccccc1)/C=N/NC(=O)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl
STK570588
Synonyms: (5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-1-(3-chlorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Clc1cccc(c1)N1C(=NC(=O)/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C1=O)S
STK570590
Synonyms: (5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(2-fluorophenyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: SC1=NC(=O)/C(=C\Nc2ccccc2F)/C(=O)N1CCC1=CCCCC1
STK570591
Synonyms: tert-butyl(6-{(2E)-2-[(2,4-dihydroxy-6-methylpyrimidin-5-yl)methylidene]hydrazinyl}-6-oxohexyl)carbamate
Smiles: O=C(N/N=C/c1c(C)nc(nc1O)O)CCCCCNC(=O)OC(C)(C)C
STK570592
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-2-(3-ethoxy-4-hydroxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: CCOc1cc(ccc1O)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/[O-]
STK570593
Synonyms: (2Z)-2-[(4-chlorophenyl)imino]-N~6~-(4-methoxyphenyl)-5-nitro-1,2-dihydropyrimidine-4,6-diamine
Smiles: COc1ccc(cc1)Nc1[nH]/c(=N/c2ccc(cc2)Cl)/nc(c1[N+](=O)[O-])N
STK570594
Synonyms: 6-(4-bromophenyl)-3-(5-methyl-1H-pyrazol-3-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: Brc1ccc(cc1)C1=Nn2c(SC1)nnc2c1n[nH]c(c1)C
STK570596
Synonyms: (8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methylbenzoate
Smiles: O=C(c1ccccc1)OCc1cc2cccc(c2[nH]c1=O)C
STK570597
Synonyms: 2'-(2,5-dimethoxyphenyl)-7'-methyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(c(c1)C1C(C(=O)c2ccccc2)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C)OC
STK570598
Synonyms: (2E)-2-[(5E)-5-(5-bromo-2-ethoxybenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(2,5-dimethylphenyl)ethanamide
Smiles: CCOc1ccc(cc1/C=c\1/s/c(=C(/C(=O)Nc2cc(C)ccc2C)\C#N)/n(c1=O)c1ccccc1)Br
STK570599
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-(3-phenoxyphenyl)pyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: CC1Cc2c(O1)ccc(c2)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)CCCn1cc[nH+]c1)/[O-]
STK570600
Synonyms: (E)-{1-[3-(diethylammonio)propyl]-2-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-4,5-dioxopyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: C=CCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1CCC[NH+](CC)CC
STK570602
Synonyms: (2Z)-7,7-dimethyl-2-[(4-methylphenyl)imino]-2,6,7,8-tetrahydroquinazolin-5(1H)-one
Smiles: Cc1ccc(cc1)/N=c/1\ncc2c([nH]1)CC(CC2=O)(C)C
STK570603
Synonyms: (4E)-5-[4-(benzyloxy)-3-ethoxyphenyl]-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)F
STK570605
Synonyms: (2Z)-2-[(2E)-(3,4-dimethoxybenzylidene)hydrazinylidene]-4-[3-(pyrrolidin-1-ylsulfonyl)phenyl]-2,3-dihydro-1,3-thiazole
Smiles: COc1cc(/C=N/N=c/2\scc([nH]2)c2cccc(c2)S(=O)(=O)N2CCCC2)ccc1OC
STK570606
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: C=CCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OCC
STK570607
Synonyms: 2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nnc1c1ccccc1Cl
STK570608
Synonyms: 2-{[4-(4-chlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethylphenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)cc(c2)C)nnc1c1cccc(c1)C
STK570609
Synonyms: 4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-N'-{(E)-[3-(trifluoromethyl)phenyl]methylidene}benzohydrazide
Smiles: O=C(c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1cccc(c1)C(F)(F)F
STK570610
Synonyms: N-[(2Z)-3-[(3,4-dimethylphenyl)amino]quinoxalin-2(1H)-ylidene]-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(c(c1)C)C
STK570611
Synonyms: (2Z)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-{[4-chloro-3-(trifluoromethyl)phenyl]amino}prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(c(c1)C(F)(F)F)Cl)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O
STK570614
Synonyms: 4-methoxy-N-[(2Z)-5-(2-phenylethyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: COc1ccc(cc1)C(=O)/N=c\1/[nH]nc(s1)CCc1ccccc1
STK570616
Synonyms: (5Z)-5-{[2,5-dimethyl-1-(5-methylpyridin-2-yl)-1H-pyrrol-3-yl]methylidene}-1-(4-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cn2)C)C)/C1=O)S
STK570617
Synonyms: (4E)-5-[4-(benzyloxy)-3-ethoxyphenyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OCC
STK570619
Synonyms: ethyl4-{[(3Z)-3-{[(2,5-dimethylphenyl)sulfonyl]imino}-3,4-dihydroquinoxalin-2-yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cc(C)ccc1C
STK570621
Synonyms: 7,7-dimethyl-2-{[(2E)-4,6,8-trimethylquinazolin-2(1H)-ylidene]amino}-7,8-dihydroquinazolin-5(6H)-one
Smiles: Cc1cc(C)c2c(c1)c(C)n/c(=N/c1ncc3c(n1)CC(CC3=O)(C)C)/[nH]2
STK570622
Synonyms: (2Z)-2-[(2E)-{4-[(3,4-dichlorobenzyl)oxy]-3-ethoxybenzylidene}hydrazinylidene]-4-(2,4-dichlorophenyl)-2,3-dihydro-1,3-thiazole
Smiles: CCOc1cc(/C=N/N=c/2\scc([nH]2)c2ccc(cc2Cl)Cl)ccc1OCc1ccc(c(c1)Cl)Cl
STK570623
Synonyms: (3S,3a'R,8a'S,8b'S)-6-chloro-7-methyl-2'-(2-methyl-3-nitrophenyl)-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: O=C1N(c2cccc(c2C)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1ccc(c2C)Cl
STK570625
Synonyms: 2-(5,6-dihydrobenzimidazo[1,2-c]quinazolin-12-ium-6-yl)-4-nitrophenolate
Smiles: [O-]c1ccc(cc1C1Nc2ccccc2c2n1c1ccccc1[nH+]2)[N+](=O)[O-]
STK570626
Synonyms: ethyl3-{[(3Z)-3-{[(3-chlorophenyl)sulfonyl]imino}-3,4-dihydroquinoxalin-2-yl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc(c1)Cl
STK570627
Synonyms: (5E)-1-(4-fluorobenzyl)-5-{[(3-fluorophenyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)CN1C(=NC(=O)/C(=C\Nc2cccc(c2)F)/C1=O)S
STK570628
Synonyms: (4E)-4-{hydroxy[4-(morpholin-4-ylsulfonyl)phenyl]methylidene}-1-(2-methoxyethyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)S(=O)(=O)N2CCOCC2)\O)/C(=O)C1=O
STK570629
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)O)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=O
STK570630
Synonyms: 6-hydroxy-3-methyl-8-(morpholin-4-yl)-7-[2-(morpholin-4-yl)ethyl]-3,7-dihydro-2H-purin-2-one
Smiles: O=c1nc(O)c2c(n1C)nc(n2CCN1CCOCC1)N1CCOCC1
STK570631
Synonyms: methylN-[(2-chlorophenyl)carbamoyl]-D-alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccccc1Cl)C
STK570633
Synonyms: (4E)-5-(4-bromophenyl)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)Br)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O
STK570634
Synonyms: (5E)-1-cyclohexyl-5-[(1-ethyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCn1cc(c2c1cccc2)/C=C/1\C(=O)N=C(N(C1=O)C1CCCCC1)S
STK570635
Synonyms: N-[6,6-dimethyl-2,4-dioxo-1-(3-phenylpropyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-3-(trifluoromethyl)benzamide
Smiles: O=C1CC(C)(C)CC2=C1C(NC(=O)c1cccc(c1)C(F)(F)F)(C(=O)N2CCCc1ccccc1)C(F)(F)F
STK570636
Synonyms: 3-{(E)-[(2Z)-{4-[3-(morpholin-4-ylsulfonyl)phenyl]-1,3-thiazol-2(3H)-ylidene}hydrazinylidene]methyl}phenol
Smiles: Oc1cccc(c1)/C=N/N=c/1\scc([nH]1)c1cccc(c1)S(=O)(=O)N1CCOCC1
STK570637
Synonyms: (4E)-5-(4-bromophenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(cc1)Br
STK570638
Synonyms: (4E)-5-[4-(benzyloxy)-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: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nnc(s1)C
STK570639
Synonyms: (4E)-5-(3-chlorophenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(furan-2-ylmethyl)pyrrolidine-2,3-dione
Smiles: Clc1cccc(c1)C1N(Cc2ccco2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O
STK570641
Synonyms: (3-acetyl-6-ethoxy-4-oxidoquinoxalin-2-yl)methyl3-nitrobenzoate
Smiles: CCOc1ccc2c(c1)[n+]([O-])c(c(n2)COC(=O)c1cccc(c1)[N+](=O)[O-])C(=O)C
STK570643
Synonyms: (4E)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-[3-ethoxy-4-(pentyloxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccccc1
STK570644
Synonyms: 4-{[(E)-(2-hydroxy-3,5-diiodophenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Ic1cc(/C=N/n2c(=S)[nH]nc2c2ccccn2)c(c(c1)I)O
STK570645
Synonyms: (5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-1-(2-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/c1ccc2c(c1)CCN2Cc1ccccc1Cl)c1ccccc1C
STK570648
Synonyms: 4-chloro-N-[(2Z)-3-[(3-methylbutyl)amino]quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: CC(CCNc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(cc1)Cl)C
STK570649
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(5-methylfuran-2-yl)methylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(o1)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N
STK570650
Synonyms: 1-(4-bromophenyl)-N-(4-ethoxyphenyl)-4-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: CCOc1ccc(cc1)NC(=S)c1n2nc(n3c2c(c1c1ccccc1)CCCC3)c1ccc(cc1)Br
STK570653
Synonyms: 4-(4-benzylpiperidin-1-yl)-4-oxo-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: CC(c1n[nH]/c(=N/C(=O)CCC(=O)N2CCC(CC2)Cc2ccccc2)/s1)C
STK570654
Synonyms: N-(4-butylphenyl)-11-(3-chlorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Cl)c(nn1c1ccccc1)C
STK570655
Synonyms: (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(2-phenylethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\NCCc1ccccc1)CCC1=CCCCC1
STK570656
Synonyms: (2Z)-2-[(3-fluorophenyl)imino]-N~6~-(4-methoxyphenyl)-5-nitro-1,2-dihydropyrimidine-4,6-diamine
Smiles: COc1ccc(cc1)Nc1[nH]/c(=N/c2cccc(c2)F)/nc(c1[N+](=O)[O-])N
STK570658
Synonyms: (4E)-5-(4-chlorophenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)Cl)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)/O
STK570659
Synonyms: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(2-fluorophenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccccc1F
STK570660
Synonyms: N-[(3Z)-1-ethyl-8-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-methylbenzamide
Smiles: CCn1[nH]/c(=N\C(=O)c2ccc(cc2)C)/c2c1nc1c(c2)cccc1C
STK570661
Synonyms: 2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}-N'-[(E)-(3,5-dibromo-2-hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccccc1)N/N=C/c1cc(Br)cc(c1O)Br
STK570662
Synonyms: N-(2,4-dimethylphenyl)-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]cyclohexanecarboxamide
Smiles: Cc1ccc(c(c1)C)N(C(=O)C1CCCCC1)Cc1cc2cccc(c2[nH]c1=O)C
STK570663
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-ethoxy-3-methoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C
STK570665
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[methyl(phenyl)amino]methyl}-N'-[(E)-(5-methylthiophen-2-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(s1)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N
STK570666
Synonyms: (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-[3-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC
STK570667
Synonyms: 1-azabicyclo[2.2.2]oct-3-yl(4-methylphenyl)methanone
Smiles: O=C(c1ccc(cc1)C)C1CN2CCC1CC2
STK570668
Synonyms: (2Z)-2-[(4-chlorophenyl)imino]-N~6~-(2,5-dimethoxyphenyl)-5-nitro-1,2-dihydropyrimidine-4,6-diamine
Smiles: COc1ccc(cc1Nc1[nH]/c(=N/c2ccc(cc2)Cl)/nc(c1[N+](=O)[O-])N)OC
STK570669
Synonyms: ethyl1-(9-methyl-4-oxo-3-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccccc1
STK570670
Synonyms: (5Z)-1-benzyl-5-{[(4-fluorophenyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)N/C=C\1/C(=O)N=C(N(C1=O)Cc1ccccc1)S
STK570672
Synonyms: 6-(4-benzylpiperidin-1-yl)-1,4-dimethyl-5-{(Z)-[3-(3-methylbutyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: CC(CCN1C(=S)S/C(=C\c2c(C)c(C#N)c(=O)n(c2N2CCC(CC2)Cc2ccccc2)C)/C1=O)C
STK570673
Synonyms: 7'-fluoro-1'-[(3-methoxyphenyl)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: COc1cccc(c1)C(=O)C1N2c3ccc(cc3C=CC2C2(C1c1ccc(cc1)C(C)C)C(=O)c1c(C2=O)cccc1)F
STK570674
Synonyms: (2E)-N-(1,3-benzodioxol-5-yl)-2-[(4-methylphenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide
Smiles: O=C1N/C(=N\c2ccc(cc2)C)/SC(C1)C(=O)Nc1ccc2c(c1)OCO2
STK570675
Synonyms: (4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(2-methoxyethyl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC(C)C)/O)/C1c1cc(OC)c(c(c1)OC)OC
STK570676
Synonyms: (8E)-7-(2-fluorobenzyl)-1,3-dimethyl-8-[(2E)-(thiophen-2-ylmethylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: Fc1ccccc1Cn1/c(=N/N=C/c2cccs2)/[nH]c2c1c(=O)n(c(=O)n2C)C
STK570677
Synonyms: 2-[(4-chlorophenyl)sulfanyl]-N-[(2Z)-5-(furan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: Clc1ccc(cc1)SCC(=O)/N=c\1/[nH]nc(s1)c1ccco1
STK570678
Synonyms: tert-butyl[(1S)-1-(5-{[(2,4-dihydroxy-6-methylpyrimidin-5-yl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)-2-(1H-indol-3-yl)ethyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)SCc1c(C)nc(nc1O)O)Cc1c[nH]c2c1cccc2
STK570680
Synonyms: 1-(4-{[(4E)-2-ethyl[1]benzofuro[3,2-d]pyrimidin-4(3H)-ylidene]amino}phenyl)ethanone
Smiles: CCc1[nH]/c(=N/c2ccc(cc2)C(=O)C)/c2c(n1)c1ccccc1o2
STK570681
Synonyms: (5E)-1-benzyl-5-{1-[(1-benzylpiperidinium-4-yl)amino]propylidene}-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)[O-])/NC1CC[NH+](CC1)Cc1ccccc1
STK570682
Synonyms: N-(3-fluoro-4-methylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccc(c(c1)F)C
STK570683
Synonyms: 2-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-{4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl}acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)Nc1cc(C)nc(n1)C)CSc1ncnc2c1cnn2c1ccc(cc1)Cl
STK570684
Synonyms: N-(2-methylpropyl)[1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: CC(CNc1ncnc2c1oc1c2cccc1)C
STK570686
Synonyms: (2E)-2-cyano-N-(2,5-dimethylphenyl)-2-[(5E)-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: N#C/C(=c/1\s/c(=C/c2ccc(o2)c2ccc(cc2)[N+](=O)[O-])/c(=O)n1c1ccccc1)/C(=O)Nc1cc(C)ccc1C
STK570688
Synonyms: methyl[(5Z)-5-{[(3-fluorophenyl)carbonyl]imino}-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetate
Smiles: COC(=O)Cc1n[nH]/c(=N/C(=O)c2cccc(c2)F)/s1
STK570689
Synonyms: 2-(2,3-dihydro-1H-indol-1-yl)-6-methyl-5-pentylpyrimidin-4-ol
Smiles: CCCCCc1c(C)nc(nc1O)N1CCc2c1cccc2
STK570690
Synonyms: (2E,5Z)-2-[(4-hydroxyphenyl)imino]-5-[4-(prop-2-en-1-yloxy)benzylidene]-1,3-thiazolidin-4-one
Smiles: C=CCOc1ccc(cc1)/C=C/1\S/C(=N/c2ccc(cc2)O)/NC1=O
STK570691
Synonyms: (E)-[4-(2-methylpropoxy)phenyl][2-(4-nitrophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: CC(COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])Cc1ccc[nH+]c1)/[O-])C
STK570692
Synonyms: N-[(2Z)-3-[(3-chlorophenyl)amino]quinoxalin-2(1H)-ylidene]-3,4-dimethylbenzenesulfonamide
Smiles: Clc1cccc(c1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc(c(c1)C)C
STK570693
Synonyms: 6-amino-4-(2,3-dimethoxyphenyl)-3-(4-propoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCOc1ccc(cc1)c1[nH]nc2c1C(C(=C(O2)N)C#N)c1cccc(c1OC)OC
STK570695
Synonyms: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenolate
Smiles: [O-]c1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1ccc(cc1)Cl)c1nonc1[NH3+]
STK570696
Synonyms: 3-(4-tert-butylphenyl)-4-(4-methylphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1ccc(cc1)C(C)(C)C
STK570697
Synonyms: 4-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylammonio)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-2-bromo-6-methoxyphenolate
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2C[NH+](C)C)c2nonc2N)cc(c1[O-])Br
STK570698
Synonyms: 11-(4-ethoxyphenyl)-N-(3-methoxyphenyl)-10-methyl-8-(pyridin-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccn1)c(Nc1cccc(c1)OC)nc1c2cccc1
STK570699
Synonyms: 6-amino-4-(2-chloro-6-fluorophenyl)-3-(4-propoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCOc1ccc(cc1)c1[nH]nc2c1C(C(=C(O2)N)C#N)c1c(F)cccc1Cl
STK570700
Synonyms: 4-tert-butyl-N-[(3E)-7-methyl-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: CC(Cn1[nH]/c(=N/C(=O)c2ccc(cc2)C(C)(C)C)/c2c1nc1cc(C)ccc1c2)C
STK570701
Synonyms: (E)-{1-[3-(dimethylammonio)propyl]-2-(4-hydroxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)O)CCC[NH+](C)C)/[O-]
STK570703
Synonyms: 2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)Nc2cc(C)nc(n2)C)nnc1c1ccc(cc1)C(C)(C)C
STK570704
Synonyms: 3-chloro-N-[(2Z)-3-{[3-(trifluoromethyl)phenyl]amino}quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Clc1cccc(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1cccc(c1)C(F)(F)F
STK570705
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N'-[(E)-(4-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)[N+](=O)[O-]
STK570706
Synonyms: (4E)-5-(3-ethoxy-4-hydroxyphenyl)-4-{hydroxy[4-(piperidin-1-ylsulfonyl)phenyl]methylidene}-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(c2ccc(c(c2)OCC)O)/C(=C(/c2ccc(cc2)S(=O)(=O)N2CCCCC2)\O)/C(=O)C1=O
STK570707
Synonyms: 2-[2-(diethylamino)ethyl]-1-(3-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCN(CCN1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)cccc1)CC
STK570709
Synonyms: N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-2-{[4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(c(c2)OC)O)nnc1c1ccccc1
STK570710
Synonyms: N'-[(1E)-1-(biphenyl-4-yl)ethylidene]-2-{[4,5-bis(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl)N/N=C(/c1ccc(cc1)c1ccccc1)\C
STK570711
Synonyms: 5-(4-fluorophenyl)-3-(3-methoxyphenyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: COc1cccc(c1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)F)c1cccc(c1)[N+](=O)[O-]
STK570714
Synonyms: N-[(3E)-6-methoxy-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]thiophene-2-carboxamide
Smiles: CCCn1[nH]/c(=N/C(=O)c2cccs2)/c2c1nc1ccc(cc1c2)OC
STK570715
Synonyms: N-[4-hydroxy-1-(4-methylphenyl)-2,6-dioxo-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)NC1(C(=O)Nc2c1c(O)nc(=O)n2c1ccc(cc1)C)C(F)(F)F
STK570716
Synonyms: (E)-{2-(4-butoxy-3-ethoxyphenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1
STK570717
Synonyms: 5-(4-fluorophenyl)-7-(4-nitrophenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine
Smiles: Fc1ccc(cc1)C1=CC(n2c(N1)nnn2)c1ccc(cc1)[N+](=O)[O-]
STK570718
Synonyms: 6-amino-4-(2-methoxyphenyl)-3-(3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: COc1cccc(c1)c1[nH]nc2c1C(C(=C(O2)N)C#N)c1ccccc1OC
STK570719
Synonyms: 6-amino-3-(4-ethoxy-3-methoxyphenyl)-4-[4-(propan-2-yloxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1ccc(cc1OC)c1[nH]nc2c1C(c1ccc(cc1)OC(C)C)C(=C(O2)N)C#N
STK570720
Synonyms: (4E)-4-{hydroxy[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1-(2-methoxyethyl)-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: COCCN1C(c2cccnc2)/C(=C(/c2ccc(cc2)OCC=C)\O)/C(=O)C1=O
STK570721
Synonyms: 3-{[(E)-(3-hydroxyphenyl)methylidene]amino}-7-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)[nH]c1c2ncn(c1=O)/N=C/c1cccc(c1)O
STK570722
Synonyms: 7,7'-propane-1,3-diylbis[6-hydroxy-3-methyl-8-(piperidin-1-yl)-3,7-dihydro-2H-purin-2-one]
Smiles: Oc1nc(=O)n(c2c1n(CCCn1c(nc3c1c(O)nc(=O)n3C)N1CCCCC1)c(n2)N1CCCCC1)C
STK570724
Synonyms: (5E)-1-(butan-2-yl)-5-{[(2-fluorophenyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCC(N1C(=NC(=O)/C(=C\Nc2ccccc2F)/C1=O)S)C
STK570725
Synonyms: (5E)-6-hydroxy-5-{1-[(2-hydroxyethyl)amino]ethylidene}-3-phenylpyrimidine-2,4(3H,5H)-dione
Smiles: OCCN/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1)O)/C
STK570726
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(3-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)OCC)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O
STK570727
Synonyms: N-(2,4-dimethoxyphenyl)-N'-[(2E)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
Smiles: COc1ccc(c(c1)OC)NC(=O)CCC(=O)/N=c/1\[nH]nc(s1)CC(C)C
STK570729
Synonyms: 5-(4-bromophenyl)-3-[5-(2,5-dichlorophenyl)furan-2-yl]-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Brc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1ccc(o1)c1cc(Cl)ccc1Cl)c1ccccc1
STK570730
Synonyms: (4E)-5-[4-(benzyloxy)-3-methoxyphenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(c(c1)OC)OCc1ccccc1
STK570731
Synonyms: 6-amino-4-(3-fluorophenyl)-3-(3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)F)c([nH]n2)c1cccc(c1)OC
STK570732
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(E)-(2-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]
STK570733
Synonyms: 7-(2-cyclohexylethyl)-4-hydroxy-1-phenyl-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Smiles: Oc1nc(=O)n(c2c1C(N=C(N2)CCC1CCCCC1)(C(F)(F)F)C(F)(F)F)c1ccccc1
STK570735
Synonyms: 3-(3-chlorophenyl)-5-[(3,4-dichlorobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Smiles: C=CCn1c(SCc2ccc(c(c2)Cl)Cl)nnc1c1cccc(c1)Cl
STK570736
Synonyms: (4E)-5-(4-butoxy-3-ethoxyphenyl)-1-{5-[(4-fluorobenzyl)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(cc2)F)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O
STK570737
Synonyms: (4E)-4-{hydroxy[4-(morpholin-4-ylsulfonyl)phenyl]methylidene}-1-(3-methoxypropyl)-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: COCCCN1C(c2ccc(cc2)C(C)C)/C(=C(/c2ccc(cc2)S(=O)(=O)N2CCOCC2)\O)/C(=O)C1=O
STK570738
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-chloro-3-nitrophenyl)methylidene]-5-propyl-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl
STK570740
Synonyms: (2E)-2-cyano-N-(4-fluorophenyl)-2-[3-(4-methylphenyl)-5-(3-nitrobenzyl)-4-oxo-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: N#C/C(=C/1\SC(C(=O)N1c1ccc(cc1)C)Cc1cccc(c1)[N+](=O)[O-])/C(=O)Nc1ccc(cc1)F
STK570741
Synonyms: 2-(1,3-benzodioxol-5-yl)-9-bromo-5-(3-nitrophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: Brc1ccc2c(c1)C1CC(=NN1C(O2)c1cccc(c1)[N+](=O)[O-])c1ccc2c(c1)OCO2
STK570742
Synonyms: (4E)-1-(6-fluoro-1,3-benzothiazol-2-yl)-5-(4-fluorophenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)c1nc2c(s1)cc(cc2)F)/O
STK570743
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{4,5-dioxo-2-[4-(propan-2-yl)phenyl]-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene}methanolate
Smiles: CC(c1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1)C
STK570744
Synonyms: 2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dibromo-4-methylphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2c(Br)cc(cc2Br)C)nnc1c1ccc(cc1)C(C)(C)C
STK570745
Synonyms: (E)-[2-(furan-2-yl)-4,5-dioxo-1-(pyridinium-4-ylmethyl)pyrrolidin-3-ylidene]{4-[(3-methylbenzyl)oxy]phenyl}methanolate
Smiles: Cc1cccc(c1)COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)Cc1cc[nH+]cc1)/[O-]
STK570746
Synonyms: (4E)-5-(4-fluorophenyl)-4-{hydroxy[4-(morpholin-4-ylsulfonyl)phenyl]methylidene}-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(c2ccc(cc2)F)/C(=C(/c2ccc(cc2)S(=O)(=O)N2CCOCC2)\O)/C(=O)C1=O
STK570747
Synonyms: N~2~,N~2~-diethyl-6-(3-methylpiperidin-1-yl)-5-nitropyrimidine-2,4-diamine
Smiles: CCN(c1nc(N2CCCC(C2)C)c(c(n1)N)[N+](=O)[O-])CC
STK570748
Synonyms: N-[(2E)-5-[(E)-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]pentanamide
Smiles: CCCCC(=O)/N=c/1\[nH]nc(s1)/C=C/c1ccc(cc1)OC
STK570750
Synonyms: (5Z)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-6-hydroxy-3-(2-phenylethyl)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/NCc2ccc3c(c2)OCO3)/C(=O)N1CCc1ccccc1
STK570751
Synonyms: 2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-14-phenyl-14H-benzo[7,8]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: c1ccc(cc1)C1c2ccc3c(c2Oc2c1c1nc(nn1cn2)CSc1nc2c(o1)cccc2)cccc3
STK570752
Synonyms: N-[(3Z)-1-butyl-6-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-2-phenoxyacetamide
Smiles: CCCCn1[nH]/c(=N\C(=O)COc2ccccc2)/c2c1nc1ccc(cc1c2)C
STK570753
Synonyms: 4-{[(E)-(5-bromothiophen-2-yl)methylidene]amino}-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Brc1ccc(s1)/C=N/n1c(S)nnc1c1n[nH]c(c1)c1ccccc1
STK570754
Synonyms: (1'S,2'S,3R,3a'R)-2'-(1,3-benzodioxol-5-ylcarbonyl)-5'-methyl-1'-[(4-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: O=C([C@H]1N2c3ccccc3C(=C[C@@H]2[C@]2([C@@H]1C(=O)c1ccc3c(c1)OCO3)C(=O)Nc1c2cccc1)C)c1ccc(cc1)[N+](=O)[O-]
STK570755
Synonyms: 6-hydroxy-7-(2-hydroxyethyl)-8-{(2E)-2-[1-(4-hydroxyphenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OCCn1c(N/N=C(/c2ccc(cc2)O)\C)nc2c1c(O)nc(=O)n2C
STK570757
Synonyms: N-[(3Z)-6-methyl-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-2-phenoxyacetamide
Smiles: CC(Cn1[nH]/c(=N\C(=O)COc2ccccc2)/c2c1nc1ccc(cc1c2)C)C
STK570758
Synonyms: 2'-[(4-chlorophenyl)carbonyl]-1'-[(3-methoxyphenyl)carbonyl]-5',7'-dimethyl-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1cccc(c1)C(=O)C1N2c3ccc(cc3C(=CC2C2(C1C(=O)c1ccc(cc1)Cl)C(=O)Nc1c2cccc1)C)C
STK570759
Synonyms: 3-[(2-fluorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)OCc1nnc(n1Cc1ccco1)SCc1ccccc1F
STK570760
Synonyms: 5-hydroxy-4-(4-methylphenyl)indeno[1,2-d][1,3]thiazin-2(4H)-one
Smiles: Cc1ccc(cc1)C1SC(=O)N=C2C1=C(O)c1c2cccc1
STK570762
Synonyms: N-(2,5-dichlorophenyl)-2-{[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nnc1c1cccc(c1)OC
STK570763
Synonyms: 4-[5-(3,4-dichlorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenylbenzoate
Smiles: O=C1N(c2ccc(c(c2)Cl)Cl)C(=O)C2C1C(c1ccc(cc1)OC(=O)c1ccccc1)N(O2)c1ccccc1
STK570764
Synonyms: N~2~-[3-(dimethylamino)propyl]-N~4~-(4-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine
Smiles: CN(CCCNc1nc(Nc2ccc(cc2)F)c(c(n1)N)[N+](=O)[O-])C
STK570765
Synonyms: (1'S,2'S,3R,3a'R)-1'-acetyl-7'-methoxy-2'-[(3-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc2c(c1)C=C[C@H]1N2[C@H](C(=O)C)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccc(c1)[N+](=O)[O-]
STK570767
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)OCc2ccccc2)nnc1COc1ccccc1
STK570768
Synonyms: 2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-4-bromophenolate
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1C(C)C)c1nonc1[NH3+])[O-]
STK570769
Synonyms: (5Z)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(3-methoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1cccc(c1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)F)C)/C1=O)S
STK570770
Synonyms: 3-(3,4-dimethoxyphenyl)-5-(2-methyl-3-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1cc(ccc1OC)C1=NOC2C1C(=O)N(C2=O)c1cccc(c1C)[N+](=O)[O-]
STK570771
Synonyms: 2-{[3-cyano-5-hydroxy-7,7-dimethyl-4-(3,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)N)N=C2C(=C(O)CC(C2)(C)C)C1c1cc(OC)c(c(c1)OC)OC
STK570772
Synonyms: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-5-(3,4-dimethoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1OC)C1N(c2noc(c2)C)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/O
STK570774
Synonyms: (E)-{1-[3-(dimethylammonio)propyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(2-methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)CCC[NH+](C)C)/[O-])C
STK570775
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-{(E)-[5-(2-nitrophenyl)furan-2-yl]methylidene}acetohydrazide
Smiles: O=C(Cc1nnc(s1)N)N/N=C/c1ccc(o1)c1ccccc1[N+](=O)[O-]
STK570776
Synonyms: (8E)-7-(2-chlorobenzyl)-1,3-dimethyl-8-[(2E)-(thiophen-2-ylmethylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1Cn1/c(=N/N=C/c2cccs2)/[nH]c2c1c(=O)n(c(=O)n2C)C
STK570778
Synonyms: (E)-[2-(4-hydroxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene][4-(2-methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)Cc1ccc[nH+]c1)/[O-])C
STK570779
Synonyms: N-[(2E)-5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: CC(C(=O)/N=c/1\[nH]nc(s1)COc1ccc(cc1)Cl)C
STK570780
Synonyms: 5-[(4-cyclohexylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl(1Z)-N-(2-chlorophenyl)-2-oxopropanehydrazonothioate
Smiles: CC(=O)/C(=N/Nc1ccccc1Cl)/Sc1nnc(n1c1ccccc1)COc1ccc(cc1)C1CCCCC1
STK570781
Synonyms: ethyl4-(3-{(Z)-[3-(4-fluorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)F
STK570782
Synonyms: (5Z)-3-benzyl-5-{1-[(2,4-dimethoxyphenyl)amino]ethylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(OC)ccc1N/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O)/C
STK570783
Synonyms: 6-chloro-4-methyl-2-oxo-2H-chromen-7-ylN-[(benzyloxy)carbonyl]norleucinate
Smiles: CCCCC(C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)C)NC(=O)OCc1ccccc1
STK570784
Synonyms: 2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C
STK570785
Synonyms: methyl2-{[(E)-(1-hexyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]amino}-4,5-dimethoxybenzoate
Smiles: CCCCCCN1C(=NC(=O)/C(=C\Nc2cc(OC)c(cc2C(=O)OC)OC)/C1=O)S
STK570786
Synonyms: N-(2-chlorophenyl)-4-(3,4-dichlorophenyl)-1-(4-ethoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1Cl)cc3c1ccc(c(c1)Cl)Cl
STK570787
Synonyms: 4-chloro-N-(5-oxo-7-phenyl-3,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1nn2c(=NC(=O)CC2c2ccccc2)[nH]1
STK570788
Synonyms: 4-fluoro-N-[(2Z)-3-[(3-fluoro-4-methylphenyl)amino]quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc(c(c1)F)C
STK570789
Synonyms: (5Z)-1-(4-ethoxyphenyl)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)F)C)/C1=O)S
STK570790
Synonyms: (4E)-5-(furan-2-yl)-4-[furan-2-yl(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Cc1onc(c1)N1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccco1
STK570791
Synonyms: 2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-phenylethanone
Smiles: Cc1ccc(cc1)OCc1nnc(n1Cc1ccco1)SCC(=O)c1ccccc1
STK570793
Synonyms: 2-{[(2E)-4,7-dimethylquinazolin-2(1H)-ylidene]amino}-7-(4-fluorophenyl)-7,8-dihydroquinazolin-5(6H)-one
Smiles: Fc1ccc(cc1)C1CC(=O)c2c(C1)nc(nc2)/N=c\1/nc(C)c2c([nH]1)cc(cc2)C
STK570794
Synonyms: (5Z)-5-[(2,3-dihydro-1H-inden-5-ylamino)methylidene]-3-(3,4-dimethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C\Nc1ccc2c(c1)CCC2)c1ccc(c(c1)C)C
STK570795
Synonyms: N-[(2Z)-3-(3,5-dimethylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: Cc1cc(C)cc(c1)N1/C(=N/C(=O)C)/SC2C1CS(=O)(=O)C2
STK570796
Synonyms: 3-(3,4-dihydroxyphenyl)-5-(4-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)C2C1C(c1ccc(c(c1)O)O)N(O2)c1ccccc1
STK570797
Synonyms: 4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1OC)/C=N/n1c(S)nnc1c1[nH]nc2c1CCC2
STK570798
Synonyms: 4-{[4-(4-fluorophenyl)piperazin-4-ium-1-yl]carbonothioyl}-2-methoxyphenolate
Smiles: COc1cc(ccc1[O-])C(=S)N1CC[NH+](CC1)c1ccc(cc1)F
STK570799
Synonyms: (5E)-5-{[1-(3-chloropropyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-1-(4-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: ClCCCN1CCc2c1ccc(c2)/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)C)S
STK570800
Synonyms: (E)-{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)CCC[NH+]1CCOCC1)/[O-])C
STK570801
Synonyms: (4E)-5-(3-bromophenyl)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(c2cccc(c2)Br)/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C1=O
STK570802
Synonyms: 4-(3-chlorophenyl)-2-[3-(3-chlorophenyl)-1-(2-methoxybenzyl)-5,5-dimethyl-2-oxoimidazolidin-4-yl]-1,2,4-oxadiazolidine-3,5-dione
Smiles: COc1ccccc1CN1C(=O)N(C(C1(C)C)n1oc(=O)n(c1=O)c1cccc(c1)Cl)c1cccc(c1)Cl
STK570805
Synonyms: 6-hydroxy-3-methyl-7-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}-8-(piperidin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: Oc1nc(=O)n(c2c1n(CCCSc1nnnn1c1ccccc1)c(n2)N1CCCCC1)C
STK570807
Synonyms: 2-chloro-N-[(2E)-5-(2-methoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: COc1ccccc1c1n[nH]/c(=N\C(=O)c2ccccc2Cl)/s1
STK570808
Synonyms: 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)c(cc2OC)Cl)nnc1c1ccc(cc1)C(C)(C)C
STK570809
Synonyms: N-[(3Z)-1,7-dimethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-nitrobenzamide
Smiles: Cc1ccc2c(c1)nc1c(c2)/c(=N/C(=O)c2ccc(cc2)[N+](=O)[O-])/[nH]n1C
STK570811
Synonyms: N-[(2E)-4-(2-bromophenyl)-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: CC(=O)/N=c\1/scc([nH]1)c1ccccc1Br
STK570813
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-[4-(pentyloxy)phenyl]pyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: CCCCCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1
STK570814
Synonyms: N-(butan-2-yl)-2-methyl[1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: CCC(Nc1nc(C)nc2c1oc1c2cccc1)C
STK570816
Synonyms: 1-[3-(3,6-diiodo-9H-carbazol-9-yl)-2-hydroxypropyl]pyrrolidine-2,5-dione
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)I)I)CN1C(=O)CCC1=O
STK570817
Synonyms: 4-{[(E)-(3,4-dihydroxyphenyl)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/c1ccc(c(c1)O)O
STK570820
Synonyms: (5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-({[2-(dimethylammonio)ethyl]amino}methylidene)-4,6-dioxo-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: C[NH+](CCN/C=C/1\C(=O)N=C(N(C1=O)CCC1=CCCCC1)[S-])C
STK570821
Synonyms: (2E)-N-[(2E)-4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2(3H)-ylidene]-3-phenylprop-2-enamide
Smiles: COc1ccc(cc1Br)c1cs/c(=N/C(=O)/C=C/c2ccccc2)/[nH]1
STK570822
Synonyms: 2-methyl-N-[(3Z)-7-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Smiles: CCCn1[nH]/c(=N\C(=O)c2ccccc2C)/c2c1nc1cc(C)ccc1c2
STK570823
Synonyms: 2-[14-(3,4-dimethoxyphenyl)-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-2-yl]phenolate
Smiles: COc1cc(ccc1OC)C1c2c(ccc3c2cccc3)Oc2c1c1nc([nH+]n1cn2)c1ccccc1[O-]
STK570825
Synonyms: 7-(3-chlorophenyl)-2-{[(2E)-6-ethyl-4-methylquinazolin-2(1H)-ylidene]amino}-7,8-dihydroquinazolin-5(6H)-one
Smiles: CCc1ccc2c(c1)c(C)n/c(=N/c1ncc3c(n1)CC(CC3=O)c1cccc(c1)Cl)/[nH]2
STK570827
Synonyms: 2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-4-bromophenolate
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1cc(Br)ccc1[O-]
STK570829
Synonyms: 10a-[(E)-2-(2,3-dichlorophenyl)ethenyl]-8,10,10-trimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: O=C1CCN2C(N1)(/C=C/c1cccc(c1Cl)Cl)C(C)(C)c1c2ccc(c1)C
STK570830
Synonyms: ethyl[(5E)-5-{[(4-fluorophenyl)carbonyl]imino}-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetate
Smiles: CCOC(=O)Cc1n[nH]/c(=N\C(=O)c2ccc(cc2)F)/s1
STK570832
Synonyms: N-(3-fluorophenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1COc1ccc(cc1)C
STK570835
Synonyms: (4E)-1-benzyl-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[4-(dimethylamino)phenyl]pyrrolidine-2,3-dione
Smiles: CN(c1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1)C
STK570836
Synonyms: 9-[(2-methylbenzyl)sulfanyl]-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7-ol
Smiles: Cc1ccccc1CSc1nnc2n1c(O)c1c(n2)c2ccccc2CC21CCCC2
STK570837
Synonyms: 7-chloro-2'-(3-methylphenyl)-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: Cc1cccc(c1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cccc2Cl
STK570838
Synonyms: (4E)-5-(4-chlorophenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OCC)/O)/C1c1ccc(cc1)Cl
STK570839
Synonyms: 3-(4,5-dimethoxy-2-nitrophenyl)-5-(4-methylphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: COc1cc([N+](=O)[O-])c(cc1OC)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)C)c1ccccc1
STK570840
Synonyms: 11-(2,4-dimethoxyphenyl)-3-heptyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1OC)OC
STK570841
Synonyms: (E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-(3-propoxyphenyl)pyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: CCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1
STK570842
Synonyms: 1-(2-fluorophenyl)-6,7-dimethyl-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CC(Cc1nnc(s1)N1C(c2ccccc2F)c2c(C1=O)oc1c(c2=O)cc(c(c1)C)C)C
STK570844
Synonyms: (5Z)-1-(4-fluorophenyl)-2,6-dioxo-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolinium-9-ylmethylidene)-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: Fc1ccc(cc1)N1C(=O)N=C(/C(=C/c2cc3CCC[NH+]4c3c(c2)CCC4)/C1=O)[O-]
STK570845
Synonyms: (5E)-5-[(1-ethyl-1H-indol-3-yl)methylidene]-1-(2-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCn1cc(c2c1cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1C)S
STK570846
Synonyms: (5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-6-hydroxy-3-(4-methoxybenzyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)CN1C(=O)N=C(/C(=C/c2cc(n(c2C)c2ccc(cc2)C)C)/C1=O)O
STK832386
Synonyms:
Smiles: COc1ccc(cc1)c1csc(n1)c1cccn(c1)CC(=O)c1ccc(cc1)Cl
STK832387
Synonyms:
Smiles: Clc1ccc(cc1)C(=O)Cn1cccc(c1)c1scc(n1)c1cccc(c1)[N+](=O)[O-]
STK946510
Synonyms:
Smiles: CN1CCN(CC1)c1ccc(cc1/C=N/NC(=O)c1ccncc1)[N](=O)O
STK946511
Synonyms:
Smiles: CCOc1ccc(cc1/C=N/NC(=O)c1cccc(c1)[N](=O)O)Cl
STK946512
Synonyms:
Smiles: C#CCOc1c(Br)cc(cc1OC)/C=N/NC(=O)c1cccc(c1)[N](=O)O
STK946513
Synonyms:
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1cccc(c1O)[N](=O)O)/s2
STK341414
Synonyms:
Smiles: O=C1O[C]2=CCC(=CC=2C(=C1)C(F)(F)F)NC(=O)c1cnn2c1NC(CC2C(F)F)c1ccc(cc1)C
STK342303
Synonyms:
Smiles: CCn1ncc(c1C)C1=NOC(C1)C(=O)Nc1c[nH]n(c1)C12CC3CC(C2)CC(C1)C3
STK510365
Synonyms:
Smiles: Nc1cn(n(c1)C)CC(c1nnc2n1CCCCC2)C
STK896738
Synonyms:
Smiles: COC(=O)C1C(=[S]/C(=C\c2ccc(cc2)N(C)C)/C1=O)Nc1ccccc1
STK893576
Synonyms:
Smiles: OC(=O)C1C2C=CC3(C1C(=O)N(C3)c1cccc(c1)[N](=O)O)O2
STK893577
Synonyms:
Smiles: CC1CC2(CCCCC2)[N](=Cc2c1cccc2)O
STK213104
Synonyms:
Smiles: COc1ccc(cc1)c1c([nH]c(n1c1ccccc1)SCC(=O)Nc1ccccc1C#N)c1ccc(cc1)OC
STK245025
Synonyms:
Smiles: O=C(Cn1c[nH]c2c1cccc2)Nc1cccc(c1)C(=O)O
STK033195
Synonyms:
Smiles: CCCC[B-]1(O)c2ccccc2NC(=[N+]1c1ccccc1)C
STK245027
Synonyms:
Smiles: O=C(Cn1c2ccccc2[nH]c1C(Cl)(Cl)Cl)Nc1scc(n1)c1ccccc1
STK245029
Synonyms:
Smiles: O=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)CSc1[nH]nc(n1N)c1cccnc1
STK032175
Synonyms:
Smiles: Clc1ccc(c(c1)Cl)Nc1scc([nH]1)c1cc2ccccc2oc1=O
STK099949
Synonyms:
Smiles: COc1ccc(cc1)Nc1scc([nH]1)c1cc2cc(OC)ccc2oc1=O
STK056447
Synonyms:
Smiles: COc1ccc(cc1)Nc1scc([nH]1)c1cc2c(oc1=O)ccc1c2cccc1
STK087356
Synonyms:
Smiles: CCOc1ccc2c(c1)oc(=O)c(c2)c1csc([nH]1)Nc1ccc(cc1)OC
STK071393
Synonyms:
Smiles: COc1ccc2c(c1)cc(c(=O)o2)c1csc([nH]1)Nc1ccc(cc1)C
STK098755
Synonyms:
Smiles: Cc1ccc(cc1)Nc1scc([nH]1)c1cc2c(oc1=O)ccc1c2cccc1
STK074027
Synonyms:
Smiles: Cc1ccc(cc1)Nc1scc([nH]1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]
STK030557
Synonyms:
Smiles: CCOc1ccc2c(c1)oc(=O)c(c2)c1csc([nH]1)Nc1ccc(cc1)C
STK025009
Synonyms:
Smiles: COc1cccc2c1oc(=O)c(c2)c1csc([nH]1)Nc1ccc(cc1)C
STK063503
Synonyms:
Smiles: Fc1ccc(cc1)Nc1scc([nH]1)c1cc2ccccc2oc1=O
STK076633
Synonyms:
Smiles: COc1ccc2c(c1)cc(c(=O)o2)c1csc([nH]1)Nc1ccc(cc1)F
STK095256
Synonyms:
Smiles: Fc1ccc(cc1)Nc1scc([nH]1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]
STK570847
Synonyms: N-cyclohexyl-3,4,5-trimethoxy-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)N(C1CCCCC1)Cc1cc2cccc(c2[nH]c1=O)C
STK570848
Synonyms: (5E)-5-(1-{[3-(morpholin-4-ium-4-yl)propyl]amino}ethylidene)-2,6-dioxo-1-phenyl-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: O=C1N=C([O-])/C(=C(\NCCC[NH+]2CCOCC2)/C)/C(=O)N1c1ccccc1
STK570850
Synonyms: N-[(2E)-5-(4-methoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: COc1ccc(cc1)c1n[nH]/c(=N\C(=O)C23CC4CC(C3)CC(C2)C4)/s1
STK570852
Synonyms: methylN-{[2-(4-fluorophenyl)ethyl]carbamoyl}-L-leucinate
Smiles: COC(=O)[C@@H](NC(=O)NCCc1ccc(cc1)F)CC(C)C
STK570853
Synonyms: 2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(dimethylamino)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1cccc(c1)Cl
STK570856
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl[2-(3-ethoxy-4-propoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Smiles: CCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1
STK570858
Synonyms: (4E)-4-{hydroxy[4-(2-methylpropoxy)phenyl]methylidene}-1-(2-methoxyethyl)-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: COCCN1C(c2cccnc2)/C(=C(/c2ccc(cc2)OCC(C)C)\O)/C(=O)C1=O
STK570859
Synonyms: N-methyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]pyridine-3-carboxamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1cccnc1)C
STK570860
Synonyms: 2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1CC)c1cccc(c1)Cl
STK570862
Synonyms: (5Z)-5-{[(1-benzylpiperidinium-4-yl)amino]methylidene}-1-(3,4-dimethylphenyl)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: O=C1N=C([O-])/C(=C/NC2CC[NH+](CC2)Cc2ccccc2)/C(=O)N1c1ccc(c(c1)C)C
STK570863
Synonyms: N-[(2Z)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-N'-[4-(propan-2-yl)phenyl]butanediamide
Smiles: CC(c1ccc(cc1)NC(=O)CCC(=O)/N=c\1/[nH]nc(s1)C1CCCCC1)C
STK570864
Synonyms: 4-(4-chlorophenyl)-N-(3,4-dichlorophenyl)-1-[4-(propan-2-yl)phenyl]-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Clc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccc(c(c1)Cl)Cl)c1ccc(cc1)C(C)C
STK570865
Synonyms: 2-chloro-7-(3,4-dimethoxyphenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1cc(ccc1OC)C1C2=C(Nc3n1ncn3)c1c(OC2)ccc(c1)Cl
STK570867
Synonyms: (3S,3a'R,8a'S,8b'S)-5-bromo-2'-(4-nitrophenyl)-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: Brc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-]
STK570868
Synonyms: (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(4-methoxyphenyl)-1-(2-phenylethyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)C1N(CCc2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O
STK570869
Synonyms: 2,6-dimethoxy-4-{(E)-[2-({[4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenylacetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2c2ccc(cc2)OC)c2ccccc2)cc(c1OC(=O)C)OC
STK570870
Synonyms: N,N-dimethyl-2-({5-[(2S)-pyrrolidin-2-yl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetamide
Smiles: O=C(N(C)C)CSc1nnc(o1)[C@@H]1CCCN1
STK570871
Synonyms: 4-[4-(4-fluorobenzyl)piperazin-1-yl]-4-oxo-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: CC(c1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)Cc2ccc(cc2)F)/s1)C
STK570872
Synonyms: (4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-methoxy-4-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)Cl
STK570873
Synonyms: (4Z)-4-[(4-methylphenyl)imino]-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Cc1ccc(cc1)/N=c/1\nc(N)nc([nH]1)CSc1nnc(s1)C
STK570874
Synonyms: (5Z)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-3-(4-fluorobenzyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Fc1ccc(cc1)CN1C(=O)N=C(/C(=C/NCc2ccc3c(c2)OCO3)/C1=O)O
STK570875
Synonyms: 6-(2,6-dimethylmorpholin-4-yl)-2-(morpholin-4-yl)-5-nitropyrimidin-4-amine
Smiles: CC1OC(C)CN(C1)c1nc(nc(c1[N+](=O)[O-])N)N1CCOCC1
STK570876
Synonyms: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-ethoxyphenolate
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2c2cccc(c2)OC)c2nonc2[NH3+])ccc1[O-]
STK570877
Synonyms: N-{[(2E)-4-(3,4-dimethoxyphenyl)-1,3-thiazol-2(3H)-ylidene]carbamothioyl}-2,4-dimethylbenzamide
Smiles: COc1cc(ccc1OC)c1cs/c(=N/C(=S)NC(=O)c2ccc(cc2C)C)/[nH]1
STK570878
Synonyms: N-(2-methoxy-5-methylphenyl)-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2OC)nnc1c1cccc(c1)C
STK570879
Synonyms: (E)-[2-(2-methoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene][4-(prop-2-en-1-yloxy)phenyl]methanolate
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1OC)Cc1ccc[nH+]c1)/[O-]
STK570881
Synonyms: 1'-[(3-methoxyphenyl)carbonyl]-5'-methyl-2'-[(4-propylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: CCCc1ccc(cc1)C(=O)C1C(C(=O)c2cccc(c2)OC)N2C(C31C(=O)Nc1c3cccc1)C=C(c1c2cccc1)C
STK570882
Synonyms: 3-(4-butoxy-3-ethoxyphenyl)-5-(4-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: CCCCOc1ccc(cc1OCC)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1
STK570883
Synonyms: 3-(benzylammonio)-4-[(2-cyanophenyl)amino]-4-oxobutanoate
Smiles: N#Cc1ccccc1NC(=O)C(CC(=O)[O-])[NH2+]Cc1ccccc1
STK570885
Synonyms: 2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C(F)(F)F)Cl)nnc1c1ccccc1Cl
STK570887
Synonyms: N-{4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl}-2-{[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)Nc2cc(C)nc(n2)C)nc2c(c1=O)c1CCCCc1s2
STK570888
Synonyms: 3-[(2,6-dichlorobenzyl)sulfanyl]-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)c1nnc(n1c1ccccc1)SCc1c(Cl)cccc1Cl
STK570889
Synonyms: (E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: C[NH+](CCN1C(c2ccncc2)/C(=C(/c2ccc(cc2)OC(C)C)\[O-])/C(=O)C1=O)C
STK570890
Synonyms: (E)-{1-[2-(morpholin-4-ium-4-yl)ethyl]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])CC[NH+]1CCOCC1)/[O-])C
STK570891
Synonyms: 3-(2-{(E)-[1-(4-chlorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-pyrrol-1-yl)benzoicacid
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C\c2cccn2c2cccc(c2)C(=O)O)/C1=O)S
STK570892
Synonyms: (3S,3a'R,8a'S,8b'S)-5,7-dimethyl-2'-(4-nitrophenyl)-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: Cc1cc(C)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-]
STK570895
Synonyms: 2-(4-benzylpiperazin-1-yl)-6-methyl-5-pentylpyrimidin-4-ol
Smiles: CCCCCc1c(C)nc(nc1O)N1CCN(CC1)Cc1ccccc1
STK570897
Synonyms: 7'-bromo-2'-(4-methoxyphenyl)-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1ccc(cc1)C1C(C(=O)c2ccccc2)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Br
STK570898
Synonyms: ethyl4-(3,4-dimethoxyphenyl)-2-[(pyrrolidin-1-ylacetyl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(c(c1)OC)OC)NC(=O)CN1CCCC1
STK570899
Synonyms: 2-{[(2E)-7-methoxy-4-methylquinazolin-2(1H)-ylidene]amino}-7,7-dimethyl-7,8-dihydroquinazolin-5(6H)-one
Smiles: COc1ccc2c(c1)[nH]/c(=N\c1ncc3c(n1)CC(CC3=O)(C)C)/nc2C
STK570900
Synonyms: 7-chloro-2'-(5-chloro-2-methylphenyl)-5-methyl-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: Clc1ccc(c(c1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(C)cc2Cl)C
STK570901
Synonyms: 1,3-dimethyl-7-(4-nitrophenyl)-8-propyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)[N+](=O)[O-]
STK570902
Synonyms: N-[(2Z)-5-(2-ethoxyethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-fluorobenzamide
Smiles: CCOCCc1n[nH]/c(=N/C(=O)c2cccc(c2)F)/s1
STK570903
Synonyms: N-[(2E)-5-(4-methoxybenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-methylbenzamide
Smiles: COc1ccc(cc1)Cc1n[nH]/c(=N\C(=O)c2ccc(cc2)C)/s1
STK570904
Synonyms: 3-(2-chlorophenyl)-4-(4-chlorophenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: Clc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1ccccc1Cl
STK570905
Synonyms: (4E)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(c(c1)OCC)OCCC(C)C
STK570906
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dibromo-4-methylphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2c(Br)cc(cc2Br)C)nnc1COc1ccc(cc1)Cl
STK570907
Synonyms: 3-(3-methoxyphenoxy)-2-methyl-4-oxo-8-(pyrrolidinium-1-ylmethyl)-4H-chromen-7-olate
Smiles: COc1cccc(c1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+]1CCCC1)[O-]
STK570909
Synonyms: (5E)-3-benzyl-5-[1-(2,3-dihydro-1H-inden-5-ylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C(\Nc2ccc3c(c2)CCC3)/C)/C(=O)N1Cc1ccccc1
STK570910
Synonyms: 7'-chloro-2'-(2-fluorophenyl)-1'-[(3-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: COc1cccc(c1)C(=O)C1N2c3ccc(cc3C=CC2C2(C1c1ccccc1F)C(=O)c1c(C2=O)cccc1)Cl
STK570912
Synonyms: 5-(4-bromophenyl)-3-chloro-7-(trifluoromethyl)-N-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: COc1cc(NC(=O)c2nn3c(c2Cl)nc(cc3C(F)(F)F)c2ccc(cc2)Br)cc(c1OC)OC
STK570913
Synonyms: 8-benzyl-4-hydroxy-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purin-2(6H)-one
Smiles: Oc1nc(=O)n(c2c1n1CCN(c1n2)Cc1ccccc1)C
STK570914
Synonyms: N-(3-bromophenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Br)nnc1COc1ccc(cc1)C
STK570915
Synonyms: 4-{[(E)-(2-hydroxynaphthalen-1-yl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c(O)ccc2c1cccc2)C
STK570916
Synonyms: 3-(4-chlorophenyl)-8-[(3-methylpiperidinium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Smiles: CC1CCC[NH+](C1)Cc1c([O-])ccc2c1occ(c2=O)c1ccc(cc1)Cl
STK570917
Synonyms: N-[(3E)-1-butyl-7-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-fluorobenzamide
Smiles: CCCCn1[nH]/c(=N/C(=O)c2ccc(cc2)F)/c2c1nc1cc(C)ccc1c2
STK570918
Synonyms: (5E)-1-(4-chlorophenyl)-2,6-dioxo-5-(1-{[3-(piperidinium-1-yl)propyl]amino}ethylidene)-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C(\NCCC[NH+]2CCCCC2)/C)/C1=O)[O-]
STK570919
Synonyms: (4E)-5-[3-(benzyloxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1cccc(c1)OCc1ccccc1
STK570920
Synonyms: 5-(4-ethoxyphenyl)-4-{[(E)-(2-nitrophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccc1[N+](=O)[O-]
STK570921
Synonyms: N-[(3Z)-1-ethyl-7-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-2-methylpropanamide
Smiles: CCn1[nH]/c(=N\C(=O)C(C)C)/c2c1nc1cc(C)ccc1c2
STK570923
Synonyms: (5E)-1-benzyl-5-({[4-(morpholin-4-ium-4-ylmethyl)phenyl]amino}methylidene)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: O=C1N=C([O-])/C(=C\Nc2ccc(cc2)C[NH+]2CCOCC2)/C(=O)N1Cc1ccccc1
STK570924
Synonyms: 3-(4-chlorophenyl)-5-(naphthalen-2-yl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: Clc1ccc(cc1)C1=NOC2C1C(=O)N(C2=O)c1ccc2c(c1)cccc2
STK570925
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-(4-nitrophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)[N+](=O)[O-]
STK570926
Synonyms: 3-(4-bromophenyl)-5-(3-chloro-2-methylphenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: Brc1ccc(cc1)C1=NOC2C1C(=O)N(C2=O)c1cccc(c1C)Cl
STK570927
Synonyms: 2-(ethylsulfanyl)-9-(2,3,4-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCSc1nc2n(n1)C(C1=C(O)CCCC1=N2)c1ccc(c(c1OC)OC)OC
STK570929
Synonyms: 4-chloro-N-{(1Z)-1-[1-cyano-2-oxo-2-(propylamino)ethylidene]-1H-isoindol-3-yl}benzamide
Smiles: CCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccc(cc1)Cl)/C#N
STK570930
Synonyms: 2-hydroxy-7-phenyl-1-(pyridin-4-ylmethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Oc1nc(=O)c2c(n1Cc1ccncc1)NC(=NC2(C(F)(F)F)C(F)(F)F)c1ccccc1
STK570931
Synonyms: (5E)-3-(furan-2-ylmethyl)-6-hydroxy-5-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\c2cn(c3c2cccc3)CCOc2ccccc2)/C(=O)N1Cc1ccco1
STK570932
Synonyms: 2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc(n1C)c1cccc(c1)Cl
STK570936
Synonyms: 7-chloro-1-{3-[(4-chlorobenzyl)oxy]phenyl}-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1cccc(c1)OCc1ccc(cc1)Cl)c(=O)c1c(o2)ccc(c1)Cl
STK570937
Synonyms: (1'S,3R,3'S,7a'S)-7''-chloro-1'-[(2,4-dichlorophenyl)carbonyl]-5''-methyl-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Clc1ccc(c(c1)Cl)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(C)cc1Cl
STK570940
Synonyms: 2-chloro-N'-[(E)-(1-hexyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]benzohydrazide
Smiles: CCCCCCN1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2Cl)/C1=O)S
STK570941
Synonyms: (2E)-3-[4-(benzyloxy)-3-methoxyphenyl]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)Nc2sc3c(c2C#N)CCC(C3)C)ccc1OCc1ccccc1
STK570943
Synonyms: N-[3-(1H-tetrazol-1-yl)phenyl]cyclopentanecarboxamide
Smiles: O=C(C1CCCC1)Nc1cccc(c1)n1cnnn1
STK570946
Synonyms: N-(3-fluoro-4-methylphenyl)-2-({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1COc1ccc(cc1)C
STK570947
Synonyms: N-[4-(butan-2-yl)phenyl]-2-{[4-methyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1C)c1cccc(c1)C)C
STK570948
Synonyms: 2-{[4-amino-5-(2,4,5,6-tetrahydrocyclopenta[c]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)c1[nH]nc2c1CCC2
STK570949
Synonyms: 7-(4-methylpiperazin-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine
Smiles: CCCc1cc(N2CCN(CC2)C)n2c(n1)c(cn2)c1ccccc1
STK570950
Synonyms: (1'S,2'S,3R,3a'R)-1'-(2,2-dimethylpropanoyl)-2'-[(4-methoxyphenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)C)C(=O)C(C)(C)C
STK570951
Synonyms: (1'S,2'S,3R,3a'R)-7'-methyl-1'-(phenylcarbonyl)-2'-(pyridin-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Cc1ccc2c(c1)C=C[C@H]1N2[C@H](C(=O)c2ccccc2)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccccn1
STK570952
Synonyms: N-[(2Z)-3-(3-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2,2-dimethylpropanamide
Smiles: COc1cccc(c1)CN1/C(=N/C(=O)C(C)(C)C)/SC2C1CS(=O)(=O)C2
STK570953
Synonyms: 3-{(2E)-2-[(6-methoxy-1H-indol-3-yl)methylidene]hydrazinyl}-5H-[1,2,4]triazino[5,6-b]indole
Smiles: COc1ccc2c(c1)[nH]cc2/C=N/Nc1nnc2c(n1)[nH]c1c2cccc1
STK570955
Synonyms: N'-[(1Z)-1-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)ethyl]benzohydrazide
Smiles: OC1=NC(=O)/C(=C(\NNC(=O)c2ccccc2)/C)/C(=N1)O
STK570957
Synonyms: (2E)-N-[(2Z)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]-3-(3-nitrophenyl)prop-2-enamide
Smiles: COc1ccc2c(c1)s/c(=N\C(=O)/C=C/c1cccc(c1)[N+](=O)[O-])/[nH]2
STK570958
Synonyms: 4-{[4-(diphenylmethyl)piperazin-1-ium-1-yl]methyl}-6-ethyl-2-oxo-2H-chromen-7-olate
Smiles: CCc1cc2c(cc1[O-])oc(=O)cc2C[NH+]1CCN(CC1)C(c1ccccc1)c1ccccc1
STK570959
Synonyms: methyl4-{[({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1CC=C)COc1ccc(cc1)Cl
STK570961
Synonyms: 4-{[(E)-(3-bromophenyl)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/c1cccc(c1)Br
STK570964
Synonyms: 4-[({[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1
STK570965
Synonyms: 4-(4-bromophenyl)-5-hydroxy-7,7-dimethyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccccc2)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)Br
STK570966
Synonyms: 2-(10-methoxy-6-oxo-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-7(6H)-yl)-N-(propan-2-yl)acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2CC(=O)NC(C)C
STK570967
Synonyms: 11-(2-methoxyphenyl)-10-methyl-2-[(2-methylphenoxy)methyl]-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)COc1ccccc1C)c1ccccc1
STK570968
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(2-methylphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccccc1/C=N/n1c(=S)[nH]nc1c1ccccc1Cl
STK570971
Synonyms: N-cyclohexyl-3-methyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: Cc1cccc(c1)C(=O)N(C1CCCCC1)Cc1cc2cc(C)ccc2[nH]c1=O
STK570972
Synonyms: (1S,2S)-N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-2-phenylcyclopropanecarbohydrazide
Smiles: COc1ccc(c(c1)/C=N/NC(=O)[C@H]1C[C@@H]1c1ccccc1)OC
STK570973
Synonyms: (2E)-3-(3-fluorophenyl)-N-[3-(1H-tetrazol-1-yl)phenyl]prop-2-enamide
Smiles: O=C(Nc1cccc(c1)n1cnnn1)/C=C/c1cccc(c1)F
STK570974
Synonyms: 2-[(3,4-dimethoxybenzyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: COc1cc(CNc2nn3c(n2)nc(cc3O)C)ccc1OC
STK570975
Synonyms: (3S,3a'R,8a'S,8b'S)-7-chloro-5-methyl-2'-(4-methylphenyl)-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: Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(C)cc2Cl
STK570976
Synonyms: 4-{[(E)-(3-fluorophenyl)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/c1cccc(c1)F
STK570977
Synonyms: N,N'-(pentane-1,5-diyldi-1,3,4-thiadiazol-2-yl-5-ylidene)diacetamide
Smiles: CC(=O)/N=c/1\[nH]nc(s1)CCCCCc1n[nH]/c(=N/C(=O)C)/s1
STK570982
Synonyms: ethyl4-[3-(2-methoxy-2-oxoethyl)-1-methyl-2,4-dioxo-1,2,3,4,6,7-hexahydro-8H-imidazo[2,1-f]purin-8-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)OC
STK570983
Synonyms: 5-nitro-2-[4-(pyridin-2-yl)piperazin-1-yl]benzaldehyde
Smiles: O=Cc1cc(ccc1N1CCN(CC1)c1ccccn1)[N+](=O)[O-]
STK570984
Synonyms: (4E)-5-(4-bromophenyl)-1-(5-bromopyridin-2-yl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: Brc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(cn1)Br
STK570985
Synonyms: N-[(1Z)-1-{1-cyano-2-[(furan-2-ylmethyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-3,4-dimethoxybenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(c(c1)OC)OC)/C(=O)NCc1ccco1
STK570988
Synonyms: 4-{[(E)-(3-phenoxyphenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1/N=C/c1cccc(c1)Oc1ccccc1)c1ccccn1
STK570995
Synonyms: 7,7-dimethyl-4-[(3-methylbutyl)sulfanyl]-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: CC(CCSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C)C
STK570996
Synonyms: 3-(3-chlorophenyl)-7-methyl-2-(2-methylpiperidin-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)N1CCCCC1C)c1cccc(c1)Cl
STK570999
Synonyms: 4-(3-chloro-4-fluorophenyl)-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1c1ccc(c(c1)Cl)F
STK571000
Synonyms: (4E)-5-[4-(dimethylamino)phenyl]-1-(furan-2-ylmethyl)-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CN(c1ccc(cc1)C1/C(=C(/c2cccc(c2)[N+](=O)[O-])\O)/C(=O)C(=O)N1Cc1ccco1)C
STK571001
Synonyms: 6-(furan-2-ylmethyl)-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)Cc1ccco1
STK571003
Synonyms: (5E)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-1-butyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCCCN1C(=NC(=O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C1=O)S
STK571006
Synonyms: 2-[3-(4-chlorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(3-methoxypropyl)acetamide
Smiles: COCCCNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Cl
STK571007
Synonyms: 2-({4-[(4-chlorophenyl)sulfonyl]piperazin-1-yl}methyl)-1-methyl-5-nitro-1H-benzimidazole
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cc1nc2c(n1C)ccc(c2)[N+](=O)[O-]
STK571008
Synonyms: 2-{5-[(3-methoxybenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazol-3-yl}pyrazine
Smiles: COc1cccc(c1)CSc1nnc(n1c1ccccc1)c1nccnc1
STK571010
Synonyms: N-(5-chloro-2-methylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C
STK571011
Synonyms: N-[(2Z)-5-[(4-chlorobenzyl)sulfonyl]-1,3,4-thiadiazol-2(3H)-ylidene]-2-fluorobenzamide
Smiles: Clc1ccc(cc1)CS(=O)(=O)c1n[nH]/c(=N/C(=O)c2ccccc2F)/s1
STK571012
Synonyms: N-butyl-6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]hexanamide
Smiles: CCCCNC(=O)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1
STK571013
Synonyms: 7-cyclohexyl-5-(4-ethylpiperazin-1-yl)-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridin-1-amine
Smiles: CCN1CCN(CC1)c1nc2[nH]nc(c2c2c1CN(CC2)C1CCCCC1)N
STK571015
Synonyms: methyl4-[2-(6-ethyl-1,3-benzothiazol-2-yl)-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Smiles: CCc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)C(=O)OC)c(=O)c1c(o2)cccc1
STK571017
Synonyms: tert-butyl(3S)-3-[(2-phenylethyl)carbamoyl]-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: O=C(N1Cc2ccccc2C[C@H]1C(=O)NCCc1ccccc1)OC(C)(C)C
STK571018
Synonyms: (2Z)-N-(1,3-benzodioxol-5-ylmethyl)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)ethanamide
Smiles: O=C(/C=C/1\NCCc2c1cc1OCOc1c2)NCc1ccc2c(c1)OCO2
STK571021
Synonyms: {(3E)-2-(4-fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}aceticacid
Smiles: OC(=O)CN1C(c2ccc(cc2)F)/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C1=O
STK571022
Synonyms: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-methylphenyl)ethanone
Smiles: Cc1ccc(cc1)C(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C
STK571023
Synonyms: 10-[4-(dimethylamino)phenyl]-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: CN(c1ccc(cc1)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C)C
STK571026
Synonyms: 2-chloro-6-(2-fluorophenyl)-7-(4-fluorophenyl)-10-(methylsulfanyl)-7,11-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1[nH]c2=NC3=C(C(n2n1)c1ccc(cc1)F)C(Oc1c3cc(Cl)cc1)c1ccccc1F
STK571027
Synonyms: 12-(1H-indol-3-yl)-2,3,4,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1-ol
Smiles: OC1=C2C(=Nc3n(C2c2c[nH]c4c2cccc4)c2ccccc2n3)CCC1
STK571028
Synonyms: N-[2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]-3-nitrobenzamide
Smiles: Cc1ccc(cc1NC(=O)c1cccc(c1)[N+](=O)[O-])c1nnc2n1nc(C)c1c2cccc1
STK571030
Synonyms: 1-[2-(4-methoxyphenyl)ethyl]-3-(1-methyl-1H-benzimidazol-2-yl)-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: COc1ccc(cc1)CCn1c(N)c(c2c1nc1ccccc1n2)c1nc2c(n1C)cccc2
STK571031
Synonyms: 5-(3-methoxyphenyl)-4-{[(E)-pyridin-3-ylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccnc1
STK571032
Synonyms: 2-(2-fluorophenyl)-10-methyl-3-phenylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: Cn1c2nc(c3ccccc3F)n(c(=O)c2c(=O)c2c1cccc2)c1ccccc1
STK571036
Synonyms: N-(2,3-dimethylphenyl)-2-{[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)C)nnc1c1cccc(c1)OC
STK571037
Synonyms: (2Z)-1-(5-bromofuran-2-yl)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)ethanone
Smiles: Brc1ccc(o1)C(=O)/C=C/1\NCCc2c1cc1OCOc1c2
STK571038
Synonyms: 4-{[({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1COc1ccc(cc1)Cl
STK571041
Synonyms: 4-{[(E)-(2,4-dimethoxyphenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(c(c1)OC)/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC
STK571042
Synonyms: N-{4-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)carbonyl]phenyl}acetamide
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc(cc1)NC(=O)C
STK571043
Synonyms: N-(3-chloro-4-fluorophenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1c1ccccc1)c1ccccn1
STK571046
Synonyms: (1S)-3-methyl-1-{5-[(3-methylbenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}butan-1-amine
Smiles: CC(C[C@@H](c1nnc(o1)SCc1cccc(c1)C)N)C
STK571048
Synonyms: N-[1-(4-fluorobenzyl)-2-hydroxy-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]benzamide
Smiles: Fc1ccc(cc1)CN1C(=NC(C1=O)(NC(=O)c1ccccc1)C(F)(F)F)O
STK571049
Synonyms: 2-(3-hydroxy-5-methyl-4H-pyrazol-4-yl)-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Smiles: O=C(CC1C(=NN=C1O)C)N/N=C/c1ccccc1C(F)(F)F
STK571051
Synonyms: (3R,3'S,3a'S,6a'R)-3'-(propan-2-yl)-5'-[2-(trifluoromethyl)phenyl]-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@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1C(F)(F)F)C(=O)Nc1c2cccc1)C
STK571052
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[4-(4-chlorophenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1
STK571055
Synonyms: (4E)-5-(3-chlorophenyl)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: Clc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O
STK571056
Synonyms: 2-(5,7-dihydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(4-fluorobenzyl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(O)cc(c2)O)NCc1ccc(cc1)F
STK571059
Synonyms: 1'-(2-methoxyethyl)-3-phenyl-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)Cc1ccccc1N1C2CN(CC1)c1ccccc1
STK571060
Synonyms: 7-chloro-1-{3-[(2-chlorobenzyl)oxy]phenyl}-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1cccc(c1)OCc1ccccc1Cl)c1noc(c1)C
STK571061
Synonyms: 4-(2-methylphenoxy)-2-[4-(propan-2-yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(Oc2ccccc2C)c2c(n1)cccc2)C
STK571063
Synonyms: (4E)-5-(2-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
Smiles: CSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccccc1F
STK571064
Synonyms: 4-{[(E)-(2-bromophenyl)methylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1Br
STK571066
Synonyms: 4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: [O-][N+](=O)c1cc(ccc1Cl)/C=N/n1c(COc2ccccc2)n[nH]c1=S
STK571068
Synonyms: 2'-hydroxy-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)cccc2)O)C
STK571069
Synonyms: 9-phenyl-6-(thiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: OC1=C2C(=Nc3n(C2c2ccccc2)ncn3)CC(C1)c1cccs1
STK571070
Synonyms: N-(2,4-dichlorophenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1
STK571071
Synonyms: N-(2-methoxy-5-methylphenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1c1ccccc1)c1ccccn1)C
STK571074
Synonyms: 7-hydroxy-4-phenyl-8-{[(pyridin-3-ylmethyl)amino]methyl}-2H-chromen-2-one
Smiles: O=c1cc(c2ccccc2)c2c(o1)c(CNCc1cccnc1)c(cc2)O
STK571077
Synonyms: 1-(4-fluorophenyl)-5-oxo-N-[(2S)-1-oxo-1-(piperidin-1-yl)propan-2-yl]pyrrolidine-3-carboxamide
Smiles: O=C(C1CC(=O)N(C1)c1ccc(cc1)F)N[C@H](C(=O)N1CCCCC1)C
STK571079
Synonyms: tert-butyl{(1S)-1-[6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-2-phenylethyl}carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc2n1N=C(CS2)c1ccc(cc1)Cl)Cc1ccccc1
STK571080
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-6-(3-chloro-4-fluorophenyl)-3-(4-methoxyphenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: COc1ccc(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)c1ccc(c(c1)Cl)F
STK571083
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nnc1COc1ccccc1
STK571085
Synonyms: 3-acetyl-2',6'-dihydroxy-8-nitro-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-4'-one
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(ccc1N1C2CN(CC1)C(=O)C)[N+](=O)[O-]
STK571087
Synonyms: N-(butan-2-yl)-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-2-carboxamide
Smiles: CCC(NC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2)C
STK571089
Synonyms: 3-butyl-8-fluoro-5-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCCCn1cnc2c(c1=O)n(C)c1c2cc(cc1)F
STK571091
Synonyms: 4-chloro-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)CC1CCCO1
STK571092
Synonyms: 4-[(E)-{[3-(pyridin-3-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccnc1
STK571093
Synonyms: (4E)-5-(3-fluorophenyl)-1-hexyl-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCCCN1C(c2cccc(c2)F)/C(=C(/c2ccccc2)\O)/C(=O)C1=O
STK571094
Synonyms: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]ethanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CSc1scc(n1)c1ccccc1
STK571095
Synonyms: 7-chloro-1-(2-methoxyphenyl)-2-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccccc1C1N(C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl
STK571097
Synonyms: 6-benzyl-2-hydroxy-1-phenyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Oc1nc(=O)c2c(n1c1ccccc1)NCN(C2)Cc1ccccc1
STK571098
Synonyms: 4-{[(E)-(4-propoxyphenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC
STK571099
Synonyms: 8-[4-(4-chlorobenzyl)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)Cc1ccc(cc1)Cl)C
STK571100
Synonyms: (5Z)-5-({1-[4-(dimethylamino)phenyl]-1H-pyrrol-2-yl}methylidene)-1-(3,4-dimethylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CN(c1ccc(cc1)n1cccc1/C=C\1/C(=O)N=C(N(C1=O)c1ccc(c(c1)C)C)S)C
STK571101
Synonyms: 8-(4-ethoxyphenyl)-3-(3-hydroxypropyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)OCC
STK571102
Synonyms: (3R,3'S,5'R)-5'-(2-amino-2-oxoethyl)-5-chloro-N-(2,5-dimethoxyphenyl)-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)CC(=O)N)OC
STK571104
Synonyms: 3-[(4-tert-butylbenzyl)sulfanyl]-5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Smiles: C=CCn1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1ccc(cc1)F
STK571105
Synonyms: N-[(2Z)-5-(ethylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)propanamide
Smiles: CCSc1n[nH]/c(=N/C(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)/s1
STK571106
Synonyms: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-phenyl[1]benzofuro[3,2-d]pyrimidine
Smiles: c1ccc(cc1)c1nc(N2CCN(CC2)Cc2ccc3c(c2)OCO3)c2c(n1)c1ccccc1o2
STK571107
Synonyms: 2-(4-methoxyphenyl)-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: COc1ccc(cc1)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2
STK571108
Synonyms: N,N-dimethyl-4-(10-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline
Smiles: CC1CCc2c(C1)c1c(s2)ncn2c1nc(n2)c1ccc(cc1)N(C)C
STK571109
Synonyms: 2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1Cc1ccco1)c1ccccc1F
STK571110
Synonyms: 3-[2-(4-methoxyphenyl)ethyl]-10-methyl-2-propylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCc1nc2c(c(=O)n1CCc1ccc(cc1)OC)c(=O)c1c(n2C)cccc1
STK571111
Synonyms: (2E)-2-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-[(2-fluorophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1F)/c1scc(n1)c1cc2cc(Cl)ccc2oc1=O
STK571112
Synonyms: N-[(2Z)-5,5-dioxido-3-(prop-2-en-1-yl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide
Smiles: C=CCN1/C(=N/C(=O)CC)/SC2C1CS(=O)(=O)C2
STK571113
Synonyms: 2,2-dimethyl-5-(2-methylpropyl)-8-(piperazin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC(Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCNCC1)C
STK571114
Synonyms: 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(9H)-one
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)nc[nH]c3=O
STK571115
Synonyms: N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylpropyl)pyridine-4-carboxamide
Smiles: CC(CN(C(=O)c1ccncc1)Cc1cc2cccc(c2[nH]c1=O)C)C
STK571116
Synonyms: methylN-[(thiophen-2-ylmethyl)carbamoyl]-L-leucinate
Smiles: COC(=O)[C@@H](NC(=O)NCc1cccs1)CC(C)C
STK571117
Synonyms: N-[3-(4-chlorophenyl)-1-ethyl-4-oxo-1,4-dihydroquinolin-2-yl]-4-fluorobenzamide
Smiles: CCn1c(NC(=O)c2ccc(cc2)F)c(c2ccc(cc2)Cl)c(=O)c2c1cccc2
STK571118
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-fluorophenyl)carbonyl]-2'-[(4-propylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2
STK571119
Synonyms: 3-benzyl-1'-(2,2-dimethoxyethyl)-6-hydroxy-6'-nitro-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: COC(CN1CC2(Cc3c1ccc(c3)[N+](=O)[O-])C(=NC(=O)N(C2=O)Cc1ccccc1)O)OC
STK571120
Synonyms: 7-hexyl-1,3-dimethyl-8-[(4-methylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(CN2CCN(CC2)C)nc2c1c(=O)n(c(=O)n2C)C
STK571121
Synonyms: methyl3,3,3-trifluoro-2-[(phenoxyacetyl)amino]-N-[6-(propan-2-yl)-1,3-benzothiazol-2(3H)-ylidene]alaninate
Smiles: COC(=O)C(C(F)(F)F)(/N=c\1/sc2c([nH]1)ccc(c2)C(C)C)NC(=O)COc1ccccc1
STK571122
Synonyms: (3a'S,6a'R)-3'-(4-hydroxybenzyl)-5'-(2-methoxyethyl)-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: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(C)cc2C
STK571125
Synonyms: (3Z)-1,1-diphenyl-3-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)propan-2-one
Smiles: O=C(C(c1ccccc1)c1ccccc1)/C=C/1\NCCc2c1cc1OCCCOc1c2
STK571126
Synonyms: (5Z)-5-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-2-sulfanyl-1,3-thiazol-4(5H)-one
Smiles: CC1Oc2c(C1)cc(cc2)/C=C/1\SC(=NC1=O)S
STK571129
Synonyms: (4E)-2-(2,4-dimethoxyphenyl)-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: COc1cc(OC)ccc1N1C(=O)/C(=C/NCCCN2CCOCC2)/c2c(C1=O)cccc2
STK571130
Synonyms: ethyl5-{2-[(2-fluorophenyl)amino]-2-oxoethoxy}-2-methyl-1-phenyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(OCC(=O)Nc1ccccc1F)cc2)c1ccccc1
STK571131
Synonyms: 8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-heptyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(CN2CCN(CC2)c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C
STK571133
Synonyms: 4-bromo-N-[(3Z)-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CC(Cn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)Br)/c2c1nc1ccccc1c2)C
STK571134
Synonyms: 9-(3-chlorophenyl)-6-(furan-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Clc1cccc(c1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccco1
STK571135
Synonyms: (5Z)-3-(4-bromobenzyl)-2-hydroxy-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}-3,5-dihydro-4H-imidazol-4-one
Smiles: C#CCn1cc(c2c1cccc2)/C=C/1\N=C(N(C1=O)Cc1ccc(cc1)Br)O
STK571136
Synonyms: 3-(2-hydroxyethyl)-7-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: OCCn1cnc2c(c1=O)[nH]c1c2ccc(c1)C
STK571137
Synonyms: 4-hydroxy-1-methyl-5-(3-nitrophenyl)pyrido[2,3-d]pyrimidin-2(1H)-one
Smiles: [O-][N+](=O)c1cccc(c1)c1ccnc2c1c(O)nc(=O)n2C
STK571138
Synonyms: (3a'S,6a'R)-5'-butyl-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)CCCC)C(=O)Nc1c2cccc1
STK571139
Synonyms: 8,8-dimethyl-3-[(3-methylbutyl)sulfanyl]-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCCC(C)C)nnc2c2c1CC(C)(C)OC2
STK571141
Synonyms: 12-(pyridin-3-yl)-2,3,4,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1-ol
Smiles: OC1=C2C(=Nc3n(C2c2cccnc2)c2ccccc2n3)CCC1
STK571144
Synonyms: (3a'S,6a'R)-5'-butyl-7-chloro-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: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cccc2Cl
STK571145
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-cyclohexylacetamide
Smiles: O=C(NC1CCCCC1)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl
STK571146
Synonyms: 2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2,3-dichlorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2Cl)Cl)N=C2C(=C(O)CCC2)C1c1ccco1
STK571150
Synonyms: ethyl4-[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]butanoate
Smiles: CCOC(=O)CCCn1c(=O)n(Cc2ccco2)c(=N)c2c1sc1c2CC(OC1)(C)C
STK571152
Synonyms: 2-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-(3-methoxypropyl)acetamide
Smiles: COCCCNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C
STK571154
Synonyms: (3a'S,6a'R)-5-bromo-3'-(1H-indol-3-ylmethyl)-5'-(4-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: COc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(Br)cc2
STK571155
Synonyms: N-(2-bromo-4-methylphenyl)-2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Br)C)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C
STK571159
Synonyms: N-(2-chlorophenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1cnc2c(c1=O)cccc2)Nc1ccccc1Cl
STK571160
Synonyms: N-(3-methoxyphenyl)-1,4-bis(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(cc1)C
STK571162
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1c1cccc(c1)Cl
STK571163
Synonyms: 9-(3-chlorophenyl)-10-hydrazinyl-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Smiles: NNc1nc2c3c(sc2c(=O)n1c1cccc(c1)Cl)nc(c1c3CC(C)(C)OC1)C
STK571165
Synonyms: 2'-amino-1'-(5-chloropyridin-2-yl)-2,5'-dioxo-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(cn2)Cl)C2=C(C31C(=O)Nc1c3cccc1)C(=O)CCC2
STK571166
Synonyms: 3-(4-chlorophenyl)-4-phenylbutan-1-amine
Smiles: NCCC(c1ccc(cc1)Cl)Cc1ccccc1
STK571167
Synonyms: 8-(3-chlorophenyl)-10-methyl-11-(pyridin-3-yl)-2-(pyridin-4-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1cccc(c1)n1nc(c2c1Oc1ncn3c(c1C2c1cccnc1)nc(n3)c1ccncc1)C
STK571168
Synonyms: pentyl[(7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)sulfanyl]acetate
Smiles: CCCCCOC(=O)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1
STK571169
Synonyms: 1-ethyl-6'-hydroxy-2,3',10-trimethyl-2H,2'H,4H-spiro[dipyrido[1,2-a:2',3'-d]pyrimidine-3,5'-pyrimidine]-2',4',5(1H,3'H)-trione
Smiles: CCN1c2nc3c(C)cccn3c(=O)c2CC2(C1C)C(=NC(=O)N(C2=O)C)O
STK571170
Synonyms: 2-methyl-1-(pyridin-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: O=C1N(C)C(c2c1oc1ccccc1c2=O)c1cccnc1
STK571171
Synonyms: N-[4-(butan-2-yl)phenyl]-2-{[5-(3-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(CC)C)nnc1c1cccc(c1)C
STK571172
Synonyms: 2-[7-(2-hydroxyethyl)-8,9-diphenyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Smiles: OCCn1c2ncn3c(c2c(c1c1ccccc1)c1ccccc1)nc(n3)c1ccccc1O
STK571173
Synonyms: (5Z)-6-hydroxy-5-[(2E)-1-hydroxy-3-(1H-indol-3-yl)prop-2-en-1-ylidene]-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C(\C=C\c2c[nH]c3c2cccc3)/O)/C1=O)O
STK571174
Synonyms: 8-(4-benzylpiperazin-1-yl)-6-hydroxy-3-methyl-7-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-3,7-dihydro-2H-purin-2-one
Smiles: Cc1nnc(s1)SCCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1
STK571175
Synonyms: 5,6,7-trimethoxy-N'-[(E)-(2-methoxyphenyl)methylidene]-1H-indole-2-carbohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)c1cc2c([nH]1)c(OC)c(c(c2)OC)OC
STK571176
Synonyms: 2-[(5E)-5-{[5-(4-methoxyphenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoicacid
Smiles: COc1ccc(cc1)c1ccc(o1)/C=C\1/SC(=S)N(C1=O)C(C(=O)O)C
STK571177
Synonyms: (1'S,3R,3'S,7a'S)-5''-fluoro-1'-{[2-(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=CCOc1ccccc1C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(F)cc1
STK571180
Synonyms: methyl5-amino-6-cyano-2-methyl-7-(pyridin-3-yl)-7H-thieno[3,2-b]pyran-3-carboxylate
Smiles: COC(=O)c1c(C)sc2c1OC(=C(C2c1cccnc1)C#N)N
STK571186
Synonyms: 3-(2-fluorobenzyl)-1,7-dimethyl-8-(tetrahydrofuran-2-ylmethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Fc1ccccc1Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)CC1CCCO1)C
STK571187
Synonyms: (1S)-1-{5-[(3-methylbenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}-2-phenylethanamine
Smiles: Cc1cccc(c1)CS(=O)(=O)c1nnc(o1)[C@H](Cc1ccccc1)N
STK571188
Synonyms: 2-(furan-2-yl)-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC1CCCc2c1c1c(s2)ncn2c1nc(n2)c1ccco1
STK571189
Synonyms: 8-(4-chlorophenyl)-4-hydroxy-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purin-2(6H)-one
Smiles: Clc1ccc(cc1)N1CCn2c1nc1c2c(O)nc(=O)n1C
STK571191
Synonyms: N-(1,3-dimethyl-2,4,6-trioxo-1,1',2',3,3',3a',4,6-octahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-7'-yl)-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C
STK571193
Synonyms: (3,5-dichlorophenyl)(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)methanone
Smiles: Clc1cc(Cl)cc(c1)C(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1
STK571194
Synonyms: 4-amino-5'-methyl-2'-oxo-1',2',6,7,11,12-hexahydro-10H-spiro[1,4-dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-2,3'-indole]-3-carbonitrile
Smiles: N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cc(C)cc1)cc1c(c3)OCCCO1
STK571196
Synonyms: (3a'S,6a'R)-5-fluoro-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)Nc2c1cc(F)cc2
STK571197
Synonyms: N-(2-ethyl-6-methylphenyl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1)C
STK571198
Synonyms: 1-(4-chlorophenyl)-2-({4-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Smiles: Clc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nnc1COc1ccc(cc1)C
STK571199
Synonyms: 5-(4-chlorophenyl)-10-(4-hydroxy-3-methoxyphenyl)-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(ccc1O)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccc(cc1)Cl)C
STK571200
Synonyms: 3-[(4-methoxybenzyl)sulfanyl]-5-(2-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)CSc1nnc(n1c1ccccc1)c1ccccc1OC
STK571201
Synonyms: 8-(2-chlorobenzyl)-1,3,6,7-tetramethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccccc1Cn1c(C)c(n2c1nc1c2c(=O)n(c(=O)n1C)C)C
STK571205
Synonyms: 2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1cccc(c1)C(F)(F)F
STK571206
Synonyms: N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-3-(dimethylsulfamoyl)benzamide
Smiles: Clc1cc(c2n(c1)c(CNC(=O)c1cccc(c1)S(=O)(=O)N(C)C)nn2)C(F)(F)F
STK571207
Synonyms: 1-[8-methyl-10-phenyl-2-(pyridin-4-yl)-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: CC(=O)C1=C(C)Oc2c(C1c1ccccc1)c1nc(nn1cn2)c1ccncc1
STK571208
Synonyms: 5-(1,3-benzodioxol-5-yl)-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc2c(c1)OCO2)N/N=C/C=C/c1ccccc1
STK571210
Synonyms: (2,5-dichlorophenyl)(5-methylidene-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-6(5H)-yl)methanone
Smiles: Clc1ccc(c(c1)C(=O)N1CCc2c(C1=C)cc1c(c2)OCO1)Cl
STK571213
Synonyms: N-[(1r,3r,5R,7R)-tricyclo[3.3.1.1~3,7~]dec-2-yl]thieno[3,2-b][1]benzothiophene-2-carboxamide
Smiles: O=C(c1cc2c(s1)c1c(s2)cccc1)NC1[C@@H]2C[C@@H]3C[C@H]1C[C@H](C2)C3
STK571214
Synonyms: 3-{[(E)-(4-fluorophenyl)methylidene]amino}-2-hydroxy-7-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)[nH]c1c2nc(n(c1=O)/N=C/c1ccc(cc1)F)O
STK571215
Synonyms: 4-{[(E)-(4-fluorophenyl)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/c1ccc(cc1)F
STK571216
Synonyms: 8-(4-methoxyphenyl)-1,6,7-trimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1)n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCCCC1
STK571217
Synonyms: 1,3-dimethyl-5-(4-methylphenyl)-10-phenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Cc1ccc(cc1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1ccccc1
STK571218
Synonyms: (10aS)-2-(4-methylphenyl)-10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1
STK571220
Synonyms: 3,3,6,6-tetramethyl-9-(4-methylphenyl)-10-(4-nitrophenyl)-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Smiles: Cc1ccc(cc1)C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)c1ccc(cc1)[N+](=O)[O-]
STK571223
Synonyms: 8-[(4-benzylpiperidin-1-yl)methyl]-7-(2-ethoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCOCCn1c(CN2CCC(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C
STK571224
Synonyms: 1-methyl-3-(2-methylpropyl)-8-(4-phenoxyphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)Oc1ccccc1)C
STK571225
Synonyms: 7-fluoro-1-(4-methoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F
STK571226
Synonyms: (2E)-1-(5-bromofuran-2-yl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Smiles: Brc1ccc(o1)C(=O)/C=C\1/NCCc2c1cc1OCCCOc1c2
STK571228
Synonyms: (3a'S,6a'R)-5-chloro-3'-(4-hydroxybenzyl)-5'-(3-methoxypropyl)-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(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(Cl)cc2
STK571229
Synonyms: 16-(4-bromophenyl)-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: Brc1ccc(cc1)C1C=C2N(C3=C1C(=O)CCC3)CCc1c2cc2OCCCOc2c1
STK571230
Synonyms: N-(4-bromo-2-fluorophenyl)-6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)hexanamide
Smiles: O=C(Nc1ccc(cc1F)Br)CCCCCn1nnc2c(c1=O)cccc2
STK571231
Synonyms: 7'-{(E)-[1-(3-fluorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-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: Fc1cccc(c1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O
STK571232
Synonyms: ethyl2-[1-(3-nitrophenyl)-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-1,3-benzothiazole-6-carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)cccc1
STK571234
Synonyms: 3-(3-chlorophenyl)-4-(4-chlorophenyl)-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: Clc1ccc(cc1)n1c(SCc2cccc(c2)C)nnc1c1cccc(c1)Cl
STK571236
Synonyms: 4-{[(E)-(2,4-dimethoxyphenyl)methylidene]amino}-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(c(c1)OC)/C=N/n1c(=S)[nH]nc1c1ccccc1OC
STK571237
Synonyms: 6-(4-fluorophenyl)-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Fc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccccc2)ncn3)C1)O
STK571238
Synonyms: 6,7-dimethoxy-2-[(3-methylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)S(=O)(=O)c1cccc(c1)C
STK571239
Synonyms: 1-amino-4-[(4-fluorophenyl)amino]-2-(propan-2-ylamino)anthracene-9,10-dione
Smiles: CC(Nc1cc(Nc2ccc(cc2)F)c2c(c1N)C(=O)c1c(C2=O)cccc1)C
STK571240
Synonyms: (2S)-N-(3,4-dimethoxyphenyl)-3-methyl-2-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: COc1cc(ccc1OC)NC(=O)[C@@H](n1cnc2c(c1=O)cccc2)C(C)C
STK571241
Synonyms: N-[(2Z)-3-(2-methoxy-5-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide
Smiles: CCC(=O)/N=C/1\SC2C(N1c1cc(C)ccc1OC)CS(=O)(=O)C2
STK571243
Synonyms: 5-[(2E)-3-(2,5-dimethoxyphenyl)prop-2-enoyl]-2,6-dihydroxy-3-(2-phenylethyl)pyrimidin-4(3H)-one
Smiles: COc1ccc(c(c1)/C=C/C(=O)c1c(O)nc(n(c1=O)CCc1ccccc1)O)OC
STK571244
Synonyms: 1'-butyl-3-(2,3-dimethylphenyl)-6-hydroxy-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: CCCCN1c2ccc(cc2CC2(C1CCC)C(=NC(=O)N(C2=O)c1cccc(c1C)C)O)[N+](=O)[O-]
STK571245
Synonyms: (5E)-6-hydroxy-5-({[2-(piperazin-1-yl)ethyl]amino}methylidene)-3-[3-(trifluoromethyl)phenyl]pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\NCCN2CCNCC2)/C(=O)N1c1cccc(c1)C(F)(F)F
STK571246
Synonyms: 2-hydroxy-N'-{(1E)-1-[4-hydroxy-1-(2-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]propyl}benzohydrazide
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/NNC(=O)c1ccccc1O
STK571248
Synonyms: 2-{(1E)-1-[4-hydroxy-2,6-dioxo-1-(prop-2-en-1-yl)-1,6-dihydropyrimidin-5(2H)-ylidene]propyl}-N-phenylhydrazinecarbothioamide
Smiles: C=CCN1C(=O)N=C(/C(=C(\NNC(=S)Nc2ccccc2)/CC)/C1=O)O
STK571250
Synonyms: N-[(2Z)-3-(2,4-difluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]tetrahydrofuran-2-carboxamide
Smiles: Fc1ccc(c(c1)F)N1/C(=N/C(=O)C2CCCO2)/SC2C1CS(=O)(=O)C2
STK571251
Synonyms: (1S,2S)-N'-[(E)-(2-chloro-6-methylquinolin-3-yl)methylidene]-2-phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cc2cc(C)ccc2nc1Cl
STK571252
Synonyms: 5-(2-methoxyphenyl)-4-{[(E)-(3-methylphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1cccc(c1)C
STK571253
Synonyms: N-(4-bromo-2-methylphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)Br)CSc1nnc(n1c1ccccc1)c1nccnc1
STK571254
Synonyms: 1-{[1,3-dimethyl-7-(3-methylbenzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)Cc1nc2c(n1Cc1cccc(c1)C)c(=O)n(c(=O)n2C)C
STK571255
Synonyms: 7-chloro-6-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1-[3-(prop-2-en-1-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: C=CCOc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C
STK571256
Synonyms: N-(4-fluorophenyl)-2-{[5-(2-fluorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)F)nnc1c1ccccc1F
STK571257
Synonyms: 1-[3-(dimethylamino)propyl]-3-(2-phenylethyl)-1,5,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: CN(CCCn1c2sc3c(c2c(=O)n(c1=O)CCc1ccccc1)CCCCC3)C
STK571258
Synonyms: (5Z)-3-(2-chlorophenyl)-5-{(2E)-3-[4-(dimethylamino)phenyl]-1-hydroxyprop-2-en-1-ylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C(\C=C\c2ccc(cc2)N(C)C)/O)/C(=O)N1c1ccccc1Cl
STK571259
Synonyms: 2,6-dichloro-4-[(E)-(4-iminio-2-oxo-2H-pyrimido[2,1-b][1,3]benzothiazol-3(4H)-ylidene)methyl]phenolate
Smiles: O=C1N=c2sc3c(n2C(=[NH2+])/C/1=C\c1cc(Cl)c(c(c1)Cl)[O-])cccc3
STK571263
Synonyms: 7-(4-fluorobenzyl)-1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)Cn1c(CN2CCCCC2C)nc2c1c(=O)n(C)c(=O)n2C
STK571265
Synonyms: (2E)-N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-3-(3-fluorophenyl)prop-2-enamide
Smiles: O=C(/C=C/c1cccc(c1)F)NCc1nnc2n1cc(Cl)cc2C(F)(F)F
STK571266
Synonyms: 6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-yl6-[(tert-butoxycarbonyl)amino]hexanoate
Smiles: O=C(Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl)CCCCCNC(=O)OC(C)(C)C
STK571267
Synonyms: 1-(4-tert-butylphenyl)-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)C(C)(C)C)c1noc(c1)C
STK571268
Synonyms: (2Z)-5-(3-methoxybenzyl)-2-{(2E)-[4-(prop-2-en-1-yloxy)benzylidene]hydrazinylidene}-2,5-dihydro-1,3-thiazol-4-ol
Smiles: C=CCOc1ccc(cc1)/C=N/N=C\1/N=C(C(S1)Cc1cccc(c1)OC)O
STK571270
Synonyms: 2-{3-[(E)-(5-iminio-2-methyl-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}phenolate
Smiles: Cc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3ccccc3[O-])C)/C2=[NH2+])s1
STK571274
Synonyms: 2-amino-N-(2-methoxyethyl)-1-(3-methylbutyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCC(C)C
STK571276
Synonyms: 5-(4-chlorophenyl)-10-(3-hydroxy-4-methoxyphenyl)-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: COc1ccc(cc1O)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccc(cc1)Cl)C
STK571277
Synonyms: N'-[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]-4,6-dimethoxy-1H-indole-2-carbohydrazide
Smiles: CCOc1ccc(cc1OC)/C=N/NC(=O)c1cc2c([nH]1)cc(cc2OC)OC
STK571278
Synonyms: 4-[(dibutylammonio)methyl]-6-oxo-6H-benzo[c]chromen-3-olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1oc(=O)c1c2cccc1)CCCC
STK571279
Synonyms: (3Z)-1-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl-1H-indol-3-yl}-3-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)propan-2-one
Smiles: COc1ccc2c(c1)c(CC(=O)/C=C/1\NCCc3c1cc(OC)c(c3)OC)c(n2C(=O)c1ccc(cc1)Cl)C
STK571280
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(9-methyl-5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)acetamide
Smiles: COc1cc(CCNC(=O)Cn2c3ccc(cc3c3c2c(=O)n2CCSc2n3)C)ccc1OC
STK571281
Synonyms: 4-[(3a'S,6a'R)-5-fluoro-3'-(1H-indol-3-ylmethyl)-2,4',6'-trioxo-1,2,2',3',3a',4',6',6a'-octahydro-5'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(F)cc2
STK571284
Synonyms: [(3aR,4R,4aR,7aS,8R,8aR)-3-(4-methylphenyl)-5,7-dioxo-3a,4,4a,5,7,7a,8,8a-octahydro-6H-4,8-methano[1,2]oxazolo[4,5-f]isoindol-6-yl]aceticacid
Smiles: OC(=O)CN1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2c1ccc(cc1)C
STK571285
Synonyms: (1S,2S)-N'-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylidene]-2-phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1ccc2c(c1)OCCO2
STK571286
Synonyms: N-(4-bromophenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccc(cc1)Br
STK571289
Synonyms: 3-(3-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)Cc1cccc(c1)Cl
STK571290
Synonyms: furan-2-yl{4-[4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]piperazin-1-yl}methanone
Smiles: CC(Cc1nc2sc3c(c2c2c1CCC2)ncnc3N1CCN(CC1)C(=O)c1ccco1)C
STK571291
Synonyms: 6-ethyl-4-[(4-methoxybenzyl)sulfanyl]-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCC1(C)OCc2c(C1)c1c(SCc3ccc(cc3)OC)nc(nc1s2)SC(C)C
STK571292
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F
STK571293
Synonyms: 5-[(3-ethoxy-4-methoxybenzyl)amino]-2-(morpholin-4-ium-4-yl)benzoate
Smiles: CCOc1cc(CNc2ccc(c(c2)C(=O)[O-])[NH+]2CCOCC2)ccc1OC
STK571294
Synonyms: 3-(3,4-dichlorobenzyl)-8-(2-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(c(c1)Cl)Cl
STK571295
Synonyms: 9-methoxy-6-[2-(naphthalen-1-yloxy)ethyl]-6H-indolo[2,3-b]quinoxaline
Smiles: COc1ccc2c(c1)c1nc3ccccc3nc1n2CCOc1cccc2c1cccc2
STK571298
Synonyms: 3-ethyl-9-(4-fluorophenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)F
STK571299
Synonyms: (5E)-5-{[1-(2-fluorobenzyl)-2-methyl-1H-indol-3-yl]methylidene}-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=NC(=O)/C(=C\c2c3ccccc3n(c2C)Cc2ccccc2F)/C1=O)S
STK571300
Synonyms: 4-butyl-6-chloro-2-oxo-2H-chromen-7-ylN-(tert-butoxycarbonyl)glycinate
Smiles: CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)CNC(=O)OC(C)(C)C
STK571301
Synonyms: 2-methyl-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)propanamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)C(C)C)CC1CCCO1
STK571302
Synonyms: 9-(3,5-difluorophenyl)-6-(4-fluorophenyl)-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)ncn3)C1)O
STK571304
Synonyms: N-(3-ethoxypropyl)-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CCOCCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2
STK571305
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1cccc(c1)[N+](=O)[O-]
STK571306
Synonyms: (5Z)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-6-hydroxy-3-(2-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C/NC2CCN(CC2)Cc2ccccc2)/C1=O)O
STK571307
Synonyms: 2-(6-ethoxy-1,3-benzothiazol-2-yl)-7-fluoro-1-(3-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1)O)c(=O)c1c(o2)ccc(c1)F
STK571308
Synonyms: 2-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(4-ethoxy-3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(c(c2)OC)OCC)c2c(C1=O)oc1c(c2=O)cccc1
STK571309
Synonyms: (3a'S,6a'R)-5'-(2-chlorobenzyl)-6,7-dimethyl-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: CC(C1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2ccc(c1C)C)C
STK571310
Synonyms: N-(5-methyl-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-phenylpropanamide
Smiles: O=C(Nc1nc2n(n1)C(CC(N2)C)c1ccccc1)CCc1ccccc1
STK571312
Synonyms: N-(butan-2-yl)-6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]hexanamide
Smiles: CCC(NC(=O)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C
STK571314
Synonyms: 1-(4-chlorophenyl)-2-hydroxy-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-4,6(1H)-dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)C2(C1=O)Cc1ccccc1N1C2CCC1)O
STK571315
Synonyms: 5-(2-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]nc1c1ccccc1Cl
STK571316
Synonyms: ethyl2-amino-5'-fluoro-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C31C(=O)Nc1c3cc(F)cc1)C(=O)CCC2
STK571317
Synonyms: N-(4-bromophenyl)-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Br)nnc1c1cccc(c1)C
STK571319
Synonyms: (2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-1-(3-nitrophenyl)ethanone
Smiles: COc1cc2CCN/C(=C\C(=O)c3cccc(c3)[N+](=O)[O-])/c2cc1OC
STK571320
Synonyms: 1-methoxy-6,12-dioxo-4b,6,7,8a,9,10,10a,10b,11,12-decahydro-9,11-methano-13-oxa-5,8-dithia-7-azabenzo[4,5]cycloocta[1,2,3-cd]-s-indacene-14-carboxylicacid
Smiles: COc1cccc2c1OC(=O)C1C(C(=O)O)C3C4C(C2c2sc(=O)[nH]c2S4)C1C3
STK571321
Synonyms: 4-{[(E)-(2,5-dimethoxyphenyl)methylidene]amino}-5-(3-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(c(c1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC)OC
STK571322
Synonyms: N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(3-methylphenyl)benzenesulfonamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(S(=O)(=O)c1ccccc1)c1cccc(c1)C
STK571325
Synonyms: 8-(4-chlorophenyl)-2-[(2-methoxyphenoxy)methyl]-11-(2-methoxyphenyl)-10-methyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)COc1ccccc1OC)c1ccc(cc1)Cl
STK571326
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl
STK571327
Synonyms: 3-(1-methyl-1H-benzimidazol-2-yl)-1-phenyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: Cn1c2ccccc2nc1c1c(N)n(c2c1nc1ccccc1n2)c1ccccc1
STK571329
Synonyms: 7-methyl-10-(pyridin-4-ylmethyl)-10,11-dihydro-5H,9H-benzo[3,4]chromeno[6,7-e][1,3]oxazin-5-one
Smiles: Cc1c2OCN(Cc2cc2c1oc(=O)c1c2cccc1)Cc1ccncc1
STK571330
Synonyms: 3-[(3a'S,6a'R)-5-chloro-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]propanamide
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cc(Cl)cc2
STK571332
Synonyms: 3-(10-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol
Smiles: CC1CCc2c(C1)c1c(s2)ncn2c1nc(n2)c1cccc(c1)O
STK571333
Synonyms: (3S)-N-{(2S)-1-[(2-methoxybenzyl)amino]-1-oxopropan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: COc1ccccc1CNC(=O)[C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C
STK571338
Synonyms: 2-({5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-(3,4-dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(s1)SCc1ccc(cc1)Cl
STK571341
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-cyclohexyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1/N=C/c1ccc(cc1)c1ccccc1)C1CCCCC1
STK571342
Synonyms: 7-(3-chlorobenzyl)-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)Cc1nc2c(n1Cc1cccc(c1)Cl)c(=O)n(c(=O)n2C)C
STK571343
Synonyms: (3a'S,6a'R)-5-fluoro-3'-(4-hydroxybenzyl)-5'-phenyl-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
STK571344
Synonyms: N-[(2Z)-3-[(3-chloro-4-fluorophenyl)amino]quinoxalin-2(1H)-ylidene]benzenesulfonamide
Smiles: Fc1ccc(cc1Cl)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccccc1
STK571345
Synonyms: 1-[2-(3,4-dimethoxybenzyl)-8-methyl-10-phenyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: COc1cc(ccc1OC)Cc1nn2c(n1)c1c(nc2)OC(=C(C1c1ccccc1)C(=O)C)C
STK571346
Synonyms: 3-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-(3-hydroxypropyl)propanamide
Smiles: OCCCNC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C
STK571347
Synonyms: (3R,3'S,3a'S,6a'R)-3'-benzyl-6-chloro-7-methyl-5'-phenyl-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(c1C)NC(=O)[C@@]12N[C@H]([C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)Cc1ccccc1
STK571349
Synonyms: (3R,3'S,3a'S,6a'R)-5'-(5-chloro-2-methoxyphenyl)-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: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@H]2C(C)C)C(=O)Nc2c1cccc2)Cl
STK571353
Synonyms: 6,7,10-trimethyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: COc1cc(cc(c1OC)OC)N1COc2c(C1)cc1c(c2C)oc(=O)c(c1C)C
STK571354
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-ethoxyphenyl)methylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N
STK571357
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-7-methyl-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1)c1sc2c(n1)ccc(c2)F
STK571359
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluorophenyl)acetamide
Smiles: O=C(Nc1cccc(c1)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl
STK571360
Synonyms: 1-{4-[(3-carboxyphenyl)amino]-5-chloro-6-oxopyridazin-1(6H)-yl}tricyclo[3.3.1.1~3,7~]decane-2-carboxylicacid
Smiles: OC(=O)c1cccc(c1)Nc1cnn(c(=O)c1Cl)C12CC3CC(C1)CC(C2C(=O)O)C3
STK571361
Synonyms: (5-methylidene-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-6(5H)-yl)[4-(pyrrolidin-1-ylsulfonyl)phenyl]methanone
Smiles: O=C(N1CCc2c(C1=C)cc1c(c2)OCO1)c1ccc(cc1)S(=O)(=O)N1CCCC1
STK571363
Synonyms: N-benzyl-3-[(4-chlorobenzyl)sulfanyl]-10-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-5-amine
Smiles: CC1CCc2c(C1)c1c(s2)nc(n2c1nnc2SCc1ccc(cc1)Cl)NCc1ccccc1
STK571364
Synonyms: 6-{3-[(4-methoxybenzyl)oxy]propyl}-7-methyl-6H-indolo[2,3-b]quinoxaline
Smiles: COc1ccc(cc1)COCCCn1c2c(C)cccc2c2c1nc1ccccc1n2
STK571365
Synonyms: methylN-{[3-(acetylamino)phenyl]carbamoyl}-L-methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)Nc1cccc(c1)NC(=O)C
STK571366
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(4-bromophenyl)carbonyl]-3'-[(2-chlorophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2
STK571367
Synonyms: (5E)-3-cyclohexyl-5-(1-{[2-(dimethylamino)ethyl]amino}ethylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CN(CCN/C(=C/1\C(=NC(=O)N(C1=O)C1CCCCC1)O)/C)C
STK571368
Synonyms: 6-(4-methoxyphenyl)-9-[4-(methylsulfanyl)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccc(cc2)SC)ncn3)C1)O
STK571370
Synonyms: 2-[(4-ethylpiperazin-1-yl)methyl]-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CCN1CCN(CC1)Cc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2
STK571371
Synonyms: N-(3-methoxypropyl)-5-methyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: COCCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2
STK571373
Synonyms: (4E)-1-(3-chloro-4-methylphenyl)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1OC)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(c(c1)Cl)C
STK571375
Synonyms: N-[3-(3-chlorophenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]butanamide
Smiles: CCCC(=O)Nc1n(C)c2ccccc2c(=O)c1c1cccc(c1)Cl
STK571377
Synonyms: 8-ethoxy-3-[2-(4-methoxyphenyl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCOc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCc1ccc(cc1)OC
STK571379
Synonyms: 2-{[4-(4-chlorophenyl)-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1OC
STK571380
Synonyms: 6-amino-4-[5-(2,5-dichlorophenyl)furan-2-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(o1)c1cc(Cl)ccc1Cl)c(C)[nH]n2
STK571382
Synonyms: 1-amino-N-(2,4-dimethoxyphenyl)-5-(morpholin-4-yl)-8-(propan-2-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cc(OC)ccc1NC(=O)c1sc2c(c1N)c1CC(OCc1c(n2)N1CCOCC1)C(C)C
STK571384
Synonyms: (5Z)-5-{2-[(2-chlorobenzyl)oxy]-5-nitrobenzylidene}-3-(3-hydroxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Oc1cccc(c1)N1C(=S)S/C(=C\c2cc(ccc2OCc2ccccc2Cl)[N+](=O)[O-])/C1=O
STK571385
Synonyms: 2-[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl)oxy]-N-(pyridin-3-ylmethyl)propanamide
Smiles: O=C(C(Oc1cc(C)cc2c1c1CCCCc1c(=O)o2)C)NCc1cccnc1
STK571386
Synonyms: (5E)-3-(4-chlorophenyl)-5-{1-[(furan-2-ylmethyl)amino]propylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/NCc1ccco1
STK571387
Synonyms: 1-(4-hydroxy-6-{[(4-methylphenyl)sulfanyl]methyl}pyrimidin-2-yl)-3-[2-(phenylsulfanyl)phenyl]guanidine
Smiles: Oc1nc(nc(c1)CSc1ccc(cc1)C)NC(=N)Nc1ccccc1Sc1ccccc1
STK571388
Synonyms: 3-(2-fluorobenzyl)-9-(4-fluorophenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(c2ccc(cc2)F)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)Cc1ccccc1F
STK571389
Synonyms: 3-(furan-2-ylmethyl)-4-imino-6,6-dimethyl-1-pentyl-1,3,4,5,6,8-hexahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-one
Smiles: CCCCCn1c(=O)n(Cc2ccco2)c(=N)c2c1sc1c2CC(OC1)(C)C
STK571391
Synonyms: N-(2,4-difluorophenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1
STK571392
Synonyms: N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}biphenyl-4-carboxamide
Smiles: Clc1cc(c2n(c1)c(CNC(=O)c1ccc(cc1)c1ccccc1)nn2)C(F)(F)F
STK571393
Synonyms: methylN-[(4-fluorophenyl)carbamoyl]-D-methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1ccc(cc1)F
STK571395
Synonyms: 2-benzyl-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: Cc1nn(c2c1C(c1cccnc1)c1c(O2)ncn2c1nc(n2)Cc1ccccc1)c1ccccc1
STK571396
Synonyms: propan-2-yl{[5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Smiles: C=CCn1c(SCC(=O)OC(C)C)nnc1c1ccc(cc1)F
STK571399
Synonyms: 5-[4-(diphenylmethyl)piperazin-1-yl]-8-methyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c(nc2n1nnn2)N1CCN(CC1)C(c1ccccc1)c1ccccc1
STK571403
Synonyms: 7-(3-chlorobenzyl)-6-hydroxy-3-methyl-8-[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]-3,7-dihydro-2H-purin-2-one
Smiles: CC(=C)CN1CCN(CC1)c1nc2c(n1Cc1cccc(c1)Cl)c(O)nc(=O)n2C
STK571404
Synonyms: 7-benzyl-3-methoxy-14H-chromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-14-one
Smiles: COc1ccc2c(c1)oc1c(c2=O)c2nc3c(n2c(n1)Cc1ccccc1)cccc3
STK571405
Synonyms: tert-butyl(3S)-3-{[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxobutan-2-yl]carbamoyl}-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: CC([C@@H](C(=O)Nc1ccc2c(c1)OCCO2)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C
STK571406
Synonyms: 7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-6-hydroxy-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OCCN1CCN(CC1)c1nc2c(n1CCSc1nc3c(s1)cccc3)c(O)nc(=O)n2C
STK571407
Synonyms: 4-methyl-N-{1-methyl-2-[2-(pyrrolidin-1-yl)ethyl]-1H-benzimidazol-5-yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)nc(n2C)CCN1CCCC1
STK571411
Synonyms: 2-ethyl-3-(furan-2-ylmethyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: CCc1nc2sc3ccccc3c(=O)c2c(=O)n1Cc1ccco1
STK571412
Synonyms: (3R,3'S,5'R)-N-(5-chloro-2-methoxyphenyl)-5,7-dimethyl-2-oxo-5'-(propan-2-yl)-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1C)C(C)C)Cl
STK571413
Synonyms: 4-methyl-N-(1-methyl-2-{2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1H-benzimidazol-5-yl)benzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1ccc2c(c1)nc(n2C)CCN1CCN(CC1)c1ccccn1
STK571414
Synonyms: 2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1c1cnccn1
STK571415
Synonyms: 4-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-(3-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC
STK571417
Synonyms: 7,7-dimethyl-4-[(2-methylprop-2-en-1-yl)sulfanyl]-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: CC(=C)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1
STK571419
Synonyms: 3-(2-chlorophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Smiles: O=C(C1ON=C(C1)c1ccccc1Cl)Nc1ccc2c(c1)OCCO2
STK571421
Synonyms: 2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc(cc1)C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)c2c1c(=O)c1c(o2)cccc1
STK571422
Synonyms: N'-[(1E)-1-(4-ethoxyphenyl)propylidene]-5-(4-methylphenyl)-1H-pyrazole-3-carbohydrazide
Smiles: CCOc1ccc(cc1)/C(=N/NC(=O)c1n[nH]c(c1)c1ccc(cc1)C)/CC
STK571424
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-(2-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)c1ccccc1
STK571425
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-7-methyl-1-[4-(propan-2-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CC(Oc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C)C
STK571429
Synonyms: 2-(4-chlorophenyl)-3-[2-(3-ethoxyphenoxy)ethyl]quinazolin-4(3H)-one
Smiles: CCOc1cccc(c1)OCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl
STK571430
Synonyms: 6-hydroxy-8-[4-(2-hydroxyethyl)piperazin-1-yl]-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OCCN1CCN(CC1)c1nc2c(n1CC(COc1cccc(c1)C)O)c(O)nc(=O)n2C
STK571431
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2-bromo-4-methylphenyl)-5-ethyl-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: CCc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Br)C
STK571432
Synonyms: 5-bromo-N-[(E)-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methylidene]pyridin-2-amine
Smiles: COc1cc2CN(CCc2cc1OC)/C=N/c1ccc(cn1)Br
STK571433
Synonyms: 3-[(3a'S,6a'R)-5'-(4-fluorobenzyl)-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]propanamide
Smiles: NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccc(cc1)F)C(=O)Nc1c2ccc(c1C)C
STK571434
Synonyms: (5E)-3-(3-chlorophenyl)-6-hydroxy-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: Clc1cccc(c1)N1C(=O)N=C(/C(=C\NCCCn2cncc2)/C1=O)O
STK571435
Synonyms: (4E)-2-(2,3-dimethylphenyl)-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1/C(=C/NCCCN2CCOCC2)/c2ccccc2C(=O)N1c1cccc(c1C)C
STK571437
Synonyms: N-[5-(acetylamino)-2-methoxyphenyl]-2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccccc1)NC(=O)C
STK571439
Synonyms: (3'E)-3'-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1'-(2-methoxyethyl)-1-(prop-2-en-1-yl)spiro[indole-3,2'-pyrrolidine]-2,4',5'(1H)-trione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C21C(=O)N(c1c2cccc1)CC=C
STK571440
Synonyms: 2-[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl)oxy]-N-[2-(morpholin-4-yl)ethyl]acetamide
Smiles: O=C(COc1cc(C)cc2c1c1CCCCc1c(=O)o2)NCCN1CCOCC1
STK571441
Synonyms: N-(3-chloro-4-methylphenyl)-2-{[3-cyano-4-(furan-2-yl)-6-hydroxy-4,5-dihydropyridin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)N=C(CC1c1ccco1)O
STK571442
Synonyms: 7-[(4-chlorobenzyl)sulfanyl]-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Smiles: Clc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CCCC3
STK571444
Synonyms: (2E)-2-{(2E)-[4-(dimethylamino)benzylidene]hydrazinylidene}-5-(3-methylbenzyl)-2,5-dihydro-1,3-thiazol-4-ol
Smiles: Cc1cccc(c1)CC1S/C(=N/N=C/c2ccc(cc2)N(C)C)/N=C1O
STK571445
Synonyms: 2-[3-(3-chlorophenyl)-2,4-dioxo-3,4,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]acetamide
Smiles: Clc1cccc(c1)n1c(=O)c2c3CCCCCc3sc2n(c1=O)CC(=O)N
STK571446
Synonyms: 3-[(2,5-dimethylbenzyl)sulfanyl]-4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)OCc1nnc(n1Cc1ccco1)SCc1cc(C)ccc1C
STK571447
Synonyms: 3-(3-chlorophenyl)-4-(4-chlorophenyl)-5-[(naphthalen-1-ylmethyl)sulfanyl]-4H-1,2,4-triazole
Smiles: Clc1ccc(cc1)n1c(SCc2cccc3c2cccc3)nnc1c1cccc(c1)Cl
STK571449
Synonyms: 2-(6-methyl-1,3-benzothiazol-2-yl)-1-[3-(prop-2-en-1-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: C=CCOc1cccc(c1)C1N(c2sc3c(n2)ccc(c3)C)C(=O)c2c1c(=O)c1c(o2)cccc1
STK571450
Synonyms: [2-({(2'S,3S,3'S,10b'R)-2'-[(4-fluorophenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl}carbonyl)phenoxy]acetonitrile
Smiles: N#CCOc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)F)C(=O)Nc1c2cccc1)cccc3
STK571452
Synonyms: methylN-[(4-phenoxyphenyl)carbamoyl]-D-alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc(cc1)Oc1ccccc1)C
STK571454
Synonyms: 2-methoxyethyl7-(4-fluorophenyl)-2,5-dimethyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: COCCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)F)nc([nH]2)C
STK571455
Synonyms: N-(4-bromophenyl)-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}acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)Br)nn2)CC(OC3)(C)C
STK571457
Synonyms: 10-methyl-6-phenyl-3-(tetrahydrofuran-2-ylmethyl)-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c(c1)c1ccccc1)CC1CCCO1
STK571458
Synonyms: 2-(1,3-benzothiazol-2-yl)-1-(pyridin-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: O=C1N(c2nc3c(s2)cccc3)C(c2c1oc1ccccc1c2=O)c1cccnc1
STK571460
Synonyms: N-cyclohexyl-2-{[6-ethyl-6-methyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Smiles: CCC1(C)OCc2c(C1)c1c(SCC(=O)NC3CCCCC3)nc(nc1s2)SC
STK571461
Synonyms: 2-{[4-(furan-2-ylmethyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1Cc1ccco1)Cc1cccs1
STK571466
Synonyms: 2-{[5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinolin-8-yl]amino}butan-1-ol
Smiles: CCC(Nc1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C)CO
STK571467
Synonyms: 4-(3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl)1-tert-butylpiperidine-1,4-dicarboxylate
Smiles: Cc1cc(OC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)c2c(c1)oc(=O)c(c2C)Cc1ccccc1
STK571470
Synonyms: (5E)-1-butyl-5-({[2-(piperazin-1-yl)ethyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCCCN1C(=NC(=O)/C(=C\NCCN2CCNCC2)/C1=O)S
STK571471
Synonyms: (6-chloropyridin-3-yl)(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)c1ccc(nc1)Cl
STK571473
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-methoxyphenyl)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: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)OC(C)C)C(=O)Nc1c2cccc1)cccc3
STK571474
Synonyms: 8-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-6-hydroxy-7-(2-hydroxy-2-phenylethyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Clc1ccc(cc1)/C=N/Nc1nc2c(n1CC(c1ccccc1)O)c(O)nc(=O)n2C
STK571475
Synonyms: N-(4-ethoxyphenyl)-Nalpha-{[1-(L-valyl)piperidin-4-yl]carbonyl}-L-phenylalaninamide
Smiles: CCOc1ccc(cc1)NC(=O)[C@@H](NC(=O)C1CCN(CC1)C(=O)[C@H](C(C)C)N)Cc1ccccc1
STK571476
Synonyms: (3S)-N-{(2R)-1-[(3-methylphenyl)amino]-1-oxopropan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: Cc1cccc(c1)NC(=O)[C@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C
STK571477
Synonyms: (5-methoxy-3-methyl-1H-indol-2-yl)[4-(3-methoxyphenyl)piperazin-1-yl]methanone
Smiles: COc1cccc(c1)N1CCN(CC1)C(=O)c1[nH]c2c(c1C)cc(cc2)OC
STK571478
Synonyms: 8-[(2E)-2-(4-ethoxybenzylidene)hydrazinyl]-6-hydroxy-7-(2-hydroxy-2-phenylethyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCOc1ccc(cc1)/C=N/Nc1nc2c(n1CC(c1ccccc1)O)c(O)nc(=O)n2C
STK571481
Synonyms: (4E)-1-(2-hydroxyethyl)-4-[hydroxy(4-methylphenyl)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1)OC
STK571484
Synonyms: 12-(2-methylphenyl)-2,3,4,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1-ol
Smiles: OC1=C2C(=Nc3n(C2c2ccccc2C)c2ccccc2n3)CCC1
STK571486
Synonyms: 4-(4-chlorophenyl)-1-(4-ethoxyphenyl)-N-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)C)n2c3c1CCCCn3c(c2)c1ccc(cc1)Cl
STK571489
Synonyms: 3-[(3-methylbenzyl)sulfanyl]-5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)n1c(COc2ccc(cc2)C)nnc1SCc1cccc(c1)C
STK571490
Synonyms: 6-ethyl-4-[(4-ethylpiperazin-1-ium-1-yl)methyl]-2-oxo-2H-chromen-7-olate
Smiles: CCN1CC[NH+](CC1)Cc1cc(=O)oc2c1cc(CC)c(c2)[O-]
STK571491
Synonyms: 2-{[(5E)-5-(acetylimino)-4,5-dihydro-1,3,4-thiadiazol-2-yl]sulfanyl}-N-(4-fluoro-3-nitrophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)[N+](=O)[O-])F)CSc1n[nH]/c(=N\C(=O)C)/s1
STK571494
Synonyms: 6-(2,6-dimethylmorpholin-4-yl)-1,4-dimethyl-5-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CC(C)C)c(n(c1=O)C)N1CC(C)OC(C1)C
STK571495
Synonyms: (1'S,2'S,3R,3a'R)-2'-[(4-chlorophenyl)carbonyl]-7'-methyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2)N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)C
STK571496
Synonyms: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-1-butyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCCCN1C(=NC(=O)/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C1=O)S
STK571497
Synonyms: 6-hydroxy-3-methyl-8-[(3-methylbutyl)sulfanyl]-7-(prop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: C=CCn1c(SCCC(C)C)nc2c1c(O)nc(=O)n2C
STK571498
Synonyms: N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-2-[4-(4-methoxyphenyl)piperazin-1-yl]acetamide
Smiles: COc1ccc(cc1)N1CCN(CC1)CC(=O)/N=c\1/sc2c([nH]1)cccc2
STK571500
Synonyms: (5s,7s)-5-butyl-7-methyl-2-(2-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCCC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1ccccc1[N+](=O)[O-])C
STK571503
Synonyms: 4-({N-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-L-methionyl}amino)butanoicacid
Smiles: CSCC[C@@H](C(=O)NCCCC(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
STK571505
Synonyms: 10-methyl-N-(pyridin-3-ylmethyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CC1CCc2c(C1)c1c(s2)ncn2c1nc(n2)C(=O)NCc1cccnc1
STK571506
Synonyms: 4-{[(E)-(2-methoxynaphthalen-1-yl)methylidene]amino}-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc2c(c1/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C)cccc2
STK571508
Synonyms: (1'S,3R,3'S,7a'S)-6''-chloro-7''-methyl-1'-(naphthalen-2-ylcarbonyl)-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: O=C([C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2ccc(c1C)Cl)c1ccc2c(c1)cccc2
STK571510
Synonyms: 6-chloro-4-ethyl-9-(3,4,5-trimethoxybenzyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: COc1cc(CN2COc3c(C2)c2oc(=O)cc(c2cc3Cl)CC)cc(c1OC)OC
STK571511
Synonyms: N-(2,4-dimethoxyphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccccc1)c1cnccn1
STK571512
Synonyms: 2-{2-[(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinolin-8-yl)amino]ethoxy}ethanol
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3NCCOCCO
STK571513
Synonyms: 5-{[(2Z)-3-(2-methoxy-5-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-5-oxopentanoicacid
Smiles: COc1ccc(cc1N1/C(=N/C(=O)CCCC(=O)O)/SC2C1CS(=O)(=O)C2)C
STK571514
Synonyms: N-[(2Z)-1,3-benzoxazol-2(3H)-ylidene]-5-cycloheptyl-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: C1CCCC(CC1)N1CNC(=NC1)/N=c/1\oc2c([nH]1)cccc2
STK571515
Synonyms: 2-[2-(dimethylamino)ethyl]-1-(2-fluorophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CN(CCN1C(=O)c2c(C1c1ccccc1F)c(=O)c1c(o2)cccc1)C
STK571516
Synonyms: (4E)-1-(2-hydroxyethyl)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: OCCN1C(c2ccc(cc2)C)/C(=C(/c2ccc(cc2)OC)\O)/C(=O)C1=O
STK571520
Synonyms: 3-[(2-fluorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-5-phenyl-4H-1,2,4-triazole
Smiles: Fc1ccccc1CSc1nnc(n1Cc1ccco1)c1ccccc1
STK571521
Synonyms: 1-[3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
Smiles: COc1ccccc1C(c1ccco1)CCn1c(nc(=S)c2c1CCCC2)c1ccccc1
STK571524
Synonyms: (3a'S,6a'R)-5-fluoro-3'-(1H-indol-3-ylmethyl)-5'-(3-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: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1cccc(c1)C)Cc1c[nH]c3c1cccc3)C(=O)N2
STK571525
Synonyms: methylN-[(1-benzylpiperidin-4-yl)carbamoyl]-D-alaninate
Smiles: COC(=O)[C@H](NC(=O)NC1CCN(CC1)Cc1ccccc1)C
STK571528
Synonyms: 5-(3-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]nc1c1cccc(c1)C
STK571529
Synonyms: 2-[(2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-2-ylmethyl)acetamide
Smiles: O=C(NCc1ccccn1)COc1ccc2c(c1)oc(=O)cc2
STK571530
Synonyms: 7-chloro-2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(3-propoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCCOc1cccc(c1)C1N(c2sc(c(n2)C)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl
STK571532
Synonyms: ethyl1'-[2-(3,4-dimethoxyphenyl)ethyl]-4'-hydroxy-8-nitro-2',6'-dioxo-1,1',2,4,4a,6'-hexahydro-2'H,3H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-3-carboxylate
Smiles: CCOC(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=NC(=O)N(C1=O)CCc1ccc(c(c1)OC)OC)O
STK571536
Synonyms: 1-octadecyl-2-phenyl-1H-benzimidazole
Smiles: CCCCCCCCCCCCCCCCCCn1c(nc2c1cccc2)c1ccccc1
STK571538
Synonyms: N-(3,4-dimethoxyphenyl)-6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)hexanamide
Smiles: COc1cc(ccc1OC)NC(=O)CCCCCn1nnc2c(c1=O)cccc2
STK571539
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1cc(ccc1Cl)C(F)(F)F
STK571540
Synonyms: (3a'S,6a'R)-3'-benzyl-5'-(3-methoxypropyl)-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(NC2Cc2ccccc2)C(=O)Nc2c1cccc2
STK571541
Synonyms: N-(1,3-benzodioxol-5-yl)-6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]hexanamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1
STK571542
Synonyms: 6-benzyl-7-(3,5-dimethylpiperidin-1-yl)-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidine
Smiles: CC1CC(C)CN(C1)c1c(Cc2ccccc2)c(C)nc2n1nc(c2c1ccccc1)C
STK571543
Synonyms: 1-ethyl-1',2,3'-trimethyl-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: CCN1c2nc3ccccn3c(=O)c2CC2(C1C)C(=O)N(C)C(=O)N(C2=O)C
STK571544
Synonyms: 1,3-dimethyl-7-(3-methylbenzyl)-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C
STK571545
Synonyms: 4-[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]butanoicacid
Smiles: OC(=O)CCCN1C(=O)C2C(C1=O)C1CC2C2C1Sc1c(C2c2cccnc2)sc(=O)[nH]1
STK571547
Synonyms: 4-hydroxy-8-(2-methoxy-5-methylphenyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: COc1ccc(cc1n1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C)C
STK571548
Synonyms: 4-{[(E)-phenylmethylidene]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/c1ccccc1
STK571549
Synonyms: 2-({5-[(1S)-1-amino-2-methylpropyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-1-(4-chlorophenyl)ethanone
Smiles: N[C@H](c1nnc(o1)SCC(=O)c1ccc(cc1)Cl)C(C)C
STK571550
Synonyms: {[(3-methoxybenzyl)sulfanyl](phenylamino)methylidene}propanedinitrile
Smiles: N#CC(=C(Nc1ccccc1)SCc1cccc(c1)OC)C#N
STK571551
Synonyms: 3-(3,4-dimethoxyphenyl)-8-[(dimethylammonio)methyl]-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: COc1ccc(cc1OC)c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+](C)C)[O-]
STK571552
Synonyms: 3-{(E)-hydroxy[1'-(2-methoxyethyl)-1-methyl-2,4',5'-trioxo-1,2-dihydro-3'H-spiro[indole-3,2'-pyrrolidin]-3'-ylidene]methyl}-N,N-dimethylbenzenesulfonamide
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)S(=O)(=O)N(C)C)/O)/C21C(=O)N(c1c2cccc1)C
STK571553
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C
STK571554
Synonyms: 2-[(4Z)-3-oxo-1-phenyl-4-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)butan-2-yl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(C(N1C(=O)c2c(C1=O)cccc2)Cc1ccccc1)/C=C/1\NCCc2c1cc1OCCCOc1c2
STK571555
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nnc1COc1ccc(cc1)Cl
STK571556
Synonyms: 12,12-dimethyl-7-[(3-methylbutyl)sulfanyl]-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Smiles: CC(CCSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C)C
STK571558
Synonyms: 5,10,10-trimethyl-2-(3-nitrophenyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: [O-][N+](=O)c1cccc(c1)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2
STK571559
Synonyms: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-6-methyl-5-[4-(propan-2-yl)benzyl]pyrimidin-4-ol
Smiles: CC(c1ccc(cc1)Cc1c(C)nc(nc1O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)C
STK571562
Synonyms: N-(4-bromophenyl)-2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Br)nnc1Cc1cccs1
STK571563
Synonyms: (5E)-1-benzyl-2-hydroxy-5-{1-[(tetrahydrofuran-2-ylmethyl)amino]propylidene}pyrimidine-4,6(1H,5H)-dione
Smiles: CC/C(=C\1/C(=O)N=C(N(C1=O)Cc1ccccc1)O)/NCC1CCCO1
STK571564
Synonyms: (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxy-3-(2-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C/c2cc(n(c2C)c2ccc(cc2)Cl)C)/C1=O)O
STK571566
Synonyms: N-(2-bromo-4-methylphenyl)-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1Br)C
STK571568
Synonyms: 2-[benzyl(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)amino]ethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C)Cc1ccccc1
STK571571
Synonyms: N-[4-(butan-2-yl)phenyl]-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)c1cnccn1)C
STK571572
Synonyms: 1-(3-hydroxyphenyl)-2-[6-(propan-2-yl)-1,3-benzothiazol-2-yl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Oc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)C(C)C)C(=O)c2c1c(=O)c1c(o2)cccc1
STK571573
Synonyms: N-(4-chlorophenyl)-2-{[6-cyano-8,8-dimethyl-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}acetamide
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCC(=O)Nc3ccc(cc3)Cl)nnc2c2c1CC(C)(C)OC2
STK571574
Synonyms: (3R,3'S,5'R)-N-(2,5-dimethoxyphenyl)-5-methyl-2-oxo-5'-(propan-2-yl)-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1)C(C)C)OC
STK571575
Synonyms: 5-(3-chlorophenyl)-4-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)C
STK571576
Synonyms: 2-methyl-7-(pyridin-3-yl)-6-(3,4,5-trimethoxyphenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1cc(cc(c1OC)OC)C1Oc2ccc(cc2C2=C1C(c1cccnc1)n1c(N2)ncn1)C
STK571578
Synonyms: 3-[(3R,3'S,3a'S,6a'R)-5'-cyclohexyl-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: OC(=O)CC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)C1CCCCC1)C(=O)Nc1c2cccc1
STK571579
Synonyms: 2-methyl-5-(naphthalen-2-yl)-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Cc1[nH]c2=NC(=CC(n2n1)c1ccccc1)c1ccc2c(c1)cccc2
STK571583
Synonyms: 6-(3-chlorophenyl)-9-(3,5-difluorophenyl)-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Clc1cccc(c1)C1CC(=C2C(=Nc3n(C2c2cc(F)cc(c2)F)nc(n3)C(F)(F)F)C1)O
STK571584
Synonyms: 1-(4-methoxyphenyl)-5-oxo-N-[(2S)-1-oxo-1-(piperidin-1-yl)propan-2-yl]pyrrolidine-3-carboxamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)N1CCCCC1)C
STK571587
Synonyms: 7-(3-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: COc1cc(ccc1OC)C1=NOC2(C1)CC(=O)N(C2=O)c1cccc(c1)Cl
STK571589
Synonyms: 2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[(2E)-4-phenyl-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(Cn1nnc2c(c1=O)cccc2)/N=c\1/scc([nH]1)c1ccccc1
STK571590
Synonyms: N-[(1Z)-3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
Smiles: COc1ccc(cc1)/C=C(/C(=O)NCCc1nc2c([nH]1)cccc2)\NC(=O)c1ccccc1Cl
STK571591
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1c(ccc(c1OC)OC)/C=N/n1c(=S)[nH]nc1c1ccccc1F
STK571594
Synonyms: N-ethyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]methanesulfonamide
Smiles: CCN(S(=O)(=O)C)Cc1cc2ccccc2[nH]c1=O
STK571595
Synonyms: 4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1c(cccc1OC)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C
STK571596
Synonyms: N-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]asparticacid
Smiles: OC(=O)CC(C(=O)O)NC=C1C(=O)N(C)C(=O)N(C1=O)C
STK571598
Synonyms: 4-(4-chlorophenyl)-1-(4-methoxyphenyl)-N-(3-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)C)cc3c1ccc(cc1)Cl
STK571599
Synonyms: N-[(2E)-3-(3-iodophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: Ic1cccc(c1)N1/C(=N\C(=O)C)/SC2C1CS(=O)(=O)C2
STK571600
Synonyms: N-[4-(benzyloxy)phenyl]-1-({1-[(4-methylphenyl)sulfonyl]piperidin-4-yl}carbonyl)-L-prolinamide
Smiles: O=C([C@@H]1CCCN1C(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)Nc1ccc(cc1)OCc1ccccc1
STK571602
Synonyms: 4-{[(E)-(5-bromo-2-fluorophenyl)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/c1cc(Br)ccc1F
STK571603
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(2,6-dichlorophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cccc(c1/C=N/n1c(=S)[nH]nc1c1ccccc1Cl)Cl
STK571605
Synonyms: 1-(2-bromophenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccccc2Br)nnc1c1ccccn1
STK571606
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCCC(C)C)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O
STK571609
Synonyms: 2-(6-methyl-1,3-benzothiazol-2-yl)-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)cccc1
STK571610
Synonyms: 2-{5-[(4-tert-butylbenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: CC(c1ccc(cc1)CSc1nnc(n1c1ccccc1)c1ccccn1)(C)C
STK571611
Synonyms: N-(4-bromo-2-fluorophenyl)-2-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: CCC(n1cnc2c(c1=O)cccc2)C(=O)Nc1ccc(cc1F)Br
STK571612
Synonyms: N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(3-methylphenyl)furan-2-carboxamide
Smiles: Cc1cccc(c1)N(C(=O)c1ccco1)Cc1cc2ccc(cc2[nH]c1=O)C
STK571613
Synonyms: N-(5-chloro-2-methylphenyl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1
STK571614
Synonyms: 1-(3-fluorophenyl)-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)C)C(=O)c2c1c(=O)c1c(o2)cccc1
STK571616
Synonyms: 4-(3-chlorophenyl)-8-methyl-1-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]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(SCC(=O)N1CCCC1)nn2)c1cccc(c1)Cl
STK571618
Synonyms: 2-{[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1N)c1n[nH]c(c1)C
STK571619
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-chlorophenyl)carbonyl]-2'-(pyridin-2-ylcarbonyl)-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)c1ccccn1)C(=O)Nc1c2cccc1)cccc3
STK571620
Synonyms: 1-{[1-(3-methoxypropyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-2-yl]carbonyl}piperidine-4-carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)N1CCC(CC1)C(=O)N
STK571621
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]hexanamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1
STK571622
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl
STK571624
Synonyms: (2Z)-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2-[(2E)-3-phenylprop-2-en-1-ylidene]-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C/C=C/c2ccccc2)/Oc2c1ccc(c2C[NH+]1CCOCC1)[O-]
STK571626
Synonyms: 2-{[4-(4-acetylpiperazin-1-yl)phenyl]amino}-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Smiles: COc1cc2c(cc1OC)CCn1c2cc(Nc2ccc(cc2)N2CCN(CC2)C(=O)C)nc1=O
STK571627
Synonyms: (4Z)-6-(1-benzofuran-2-yl)-4-[(2-methoxyphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: COc1ccccc1/N=c/1\nc(N)nc([nH]1)c1cc2c(o1)cccc2
STK571628
Synonyms: 6-(2-chlorobenzyl)-1-(3-fluorophenyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Fc1cccc(c1)n1c(S)nc(=O)c2c1NCN(C2)Cc1ccccc1Cl
STK571630
Synonyms: 7-(4-chlorobenzyl)-8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)n(c(=O)n2C)C
STK571631
Synonyms: 6-(2-hydroxyphenyl)-9-(4-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Oc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1O
STK571632
Synonyms: N-(3,4-difluorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1Cc1ccco1)COc1ccccc1
STK571633
Synonyms: (4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-methyl-5-(2-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1[N+](=O)[O-])C)/O
STK571634
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
Smiles: Clc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1C(F)(F)F)Cl
STK571635
Synonyms: 6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(2-methoxyethyl)hexanamide
Smiles: COCCNC(=O)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1
STK571636
Synonyms: (2E)-2-cyano-3-(4-ethoxy-3-methoxyphenyl)-N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]prop-2-enamide
Smiles: CCOc1ccc(cc1OC)/C=C(/C(=O)/N=c\1/[nH]nc(s1)CC)\C#N
STK571637
Synonyms: 2-(benzylsulfanyl)-9-(pyridin-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: OC1=C2C(=Nc3n(C2c2ccccn2)nc(n3)SCc2ccccc2)CCC1
STK571638
Synonyms: 2-(2-fluorophenyl)-10-methyl-3-pentylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccccc1F
STK571639
Synonyms: 3-[(3a'S,6a'R)-5'-(4-fluorobenzyl)-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: NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccc(cc1)F)C(=O)Nc1c2cccc1
STK571640
Synonyms: 2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1
STK571641
Synonyms: 6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-ylN-(tert-butoxycarbonyl)-D-valinate
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl)C(C)C
STK571643
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-methyl-1H-benzimidazol-1-yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CCn1c(C)nc2c1cccc2
STK571644
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-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)nnc1COc1ccccc1
STK571646
Synonyms: (2'S,3S,3'S,10b'R)-3'-(2,2-dimethylpropanoyl)-2'-{[2-(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=CCOc1ccccc1C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C
STK571647
Synonyms: N-(3-fluorophenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)F)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1
STK571648
Synonyms: 1-amino-4-[(4-methoxyphenyl)amino]-2-(propan-2-ylamino)anthracene-9,10-dione
Smiles: COc1ccc(cc1)Nc1cc(NC(C)C)c(c2c1C(=O)c1ccccc1C2=O)N
STK571649
Synonyms: 10-(2,4-dihydroxyphenyl)-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: Cc1ccc(cc1)c1c2c(c3n1CCOC3c1ccc(cc1O)O)n(C)c(=O)n(c2=O)C
STK571650
Synonyms: N-(4-bromophenyl)-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)Nc1ccc(cc1)Br
STK571651
Synonyms: 2-methyl-3-(piperidinium-1-ylmethyl)benzo[h]quinolin-4-olate
Smiles: Cc1nc2c(c(c1C[NH+]1CCCCC1)[O-])ccc1c2cccc1
STK571653
Synonyms: N-[2-(2-hydroxyethoxy)ethyl]-5,11-dimethyl-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(nc2C)sc2c1C(C)CCC2
STK571654
Synonyms: N-(3,4-dimethylphenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C
STK571655
Synonyms: 2-chloro-N'-{(E)-[1-(2-methoxyphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}benzohydrazide
Smiles: COc1ccccc1N1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2Cl)/C1=O)S
STK571656
Synonyms: 7-[(2-fluorobenzyl)oxy]-3-(2-methoxyphenoxy)-4H-chromen-4-one
Smiles: COc1ccccc1Oc1coc2c(c1=O)ccc(c2)OCc1ccccc1F
STK571657
Synonyms: 9-(3-ethoxy-4-hydroxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCOc1cc(ccc1O)C1C2=C(O)CC(CC2=Nc2n1ncn2)(C)C
STK571658
Synonyms: N-(2-ethoxyphenyl)-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2OCC)nnc1COc1ccccc1
STK571659
Synonyms: (3E)-3-[2-(2,4-dimethoxyphenyl)-2-oxoethylidene]-1,3-dihydro-2H-indol-2-one
Smiles: COc1cc(OC)ccc1C(=O)/C=C\1/C(=O)Nc2c1cccc2
STK571662
Synonyms: 5-(ethenylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: C=CNc1ccc2c3c1C(=O)c1ccccc1c3on2
STK571665
Synonyms: N-(4-chlorophenyl)-2-{[2-(3-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nc(SCC(=O)Nc2ccc(cc2)Cl)c2c(n1)CC(OC2)(C)C
STK571666
Synonyms: (1S)-1-{5-[(3-chlorobenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}-2-methylpropan-1-amine
Smiles: CC([C@@H](c1nnc(o1)SCc1cccc(c1)Cl)N)C
STK571667
Synonyms: 3-benzyl-2-(4-methylphenyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: Cc1ccc(cc1)c1nc2sc3ccccc3c(=O)c2c(=O)n1Cc1ccccc1
STK571669
Synonyms: (2Z)-2-(4-ethylbenzylidene)-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]
STK571673
Synonyms: 4-acetyl-N-methyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccc(cc1)C(=O)C)C
STK571674
Synonyms: 10-methyl-N-[3-(morpholin-4-yl)propyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CC1CCc2c(C1)c1c(s2)ncn2c1nc(n2)C(=O)NCCCN1CCOCC1
STK571675
Synonyms: 2-[benzyl(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]ethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CCC)Cc1ccccc1
STK571676
Synonyms: (4E)-2-(2-chloro-4-fluorophenyl)-4-{[(3-methoxyphenyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: COc1cccc(c1)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1Cl)F
STK571677
Synonyms: N-{(1Z)-1-[2-(butylamino)-1-cyano-2-oxoethylidene]-1H-isoindol-3-yl}-2-methylbenzamide
Smiles: CCCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccccc1C)/C#N
STK571679
Synonyms: tert-butyl(3S)-3-{[2-(4-methoxyphenyl)ethyl]carbamoyl}-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: COc1ccc(cc1)CCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C
STK571680
Synonyms: (3a'S,6a'R)-5'-(1,3-benzodioxol-5-yl)-5-chloro-3'-(3,4-dihydroxybenzyl)-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)c1ccc3c(c1)OCO3)Cc1ccc(c(c1)O)O)C(=O)N2
STK571681
Synonyms: N,N-diethyl-2-(7-methoxy-2-methyl-4H-[1,3]thiazolo[5,4-b]indol-4-yl)ethanamine
Smiles: CCN(CCn1c2ccc(cc2c2c1sc(n2)C)OC)CC
STK571682
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-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C
STK571687
Synonyms: methylN-[(2-fluorobenzyl)carbamoyl]-D-alaninate
Smiles: COC(=O)[C@H](NC(=O)NCc1ccccc1F)C
STK571688
Synonyms: 9,10-dimethoxy-2-[3-(trifluoromethyl)phenoxy]-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Smiles: COc1cc2CCn3c(c2cc1OC)cc(nc3=O)Oc1cccc(c1)C(F)(F)F
STK571689
Synonyms: (5E)-5-[(1-butyl-2,3-dihydro-1H-indol-5-yl)methylidene]-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CCCCN1CCc2c1ccc(c2)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O
STK571690
Synonyms: 4-({(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}amino)-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(ccc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC
STK571691
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-fluorophenyl)carbonyl]-2'-{[2-(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=CCOc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2
STK571692
Synonyms: (2Z,5Z)-5-(4-chlorobenzylidene)-2-[(4-methoxyphenyl)imino]-2,5-dihydro-1,3-thiazol-4-ol
Smiles: COc1ccc(cc1)/N=C/1\S/C(=C\c2ccc(cc2)Cl)/C(=N1)O
STK571693
Synonyms: N-[2-(morpholin-4-yl)-5-(3-propyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenyl]benzenesulfonamide
Smiles: CCCc1nnc2n1nc(c1ccc(c(c1)NS(=O)(=O)c1ccccc1)N1CCOCC1)c1c2cccc1
STK571695
Synonyms: (4E)-4-{[(5-chloropyridin-2-yl)amino]methylidene}-2-(2-methoxyphenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccccc1N1C(=O)/C(=C/Nc2ccc(cn2)Cl)/c2c(C1=O)cccc2
STK571696
Synonyms: 7-chloro-1-(3,4-dimethoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(ccc1OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl
STK571699
Synonyms: 4-methoxy-N-[1-methyl-3-(4-methylphenyl)-4-oxo-1,4-dihydroquinolin-2-yl]benzamide
Smiles: COc1ccc(cc1)C(=O)Nc1c(c2ccc(cc2)C)c(=O)c2c(n1C)cccc2
STK571700
Synonyms: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-methyl-2-phenyl-3,5-dihydro-4H-imidazol-4-one
Smiles: O=C1/C(=C/c2ccc3c(c2)OCO3)/N=C(N1C)c1ccccc1
STK571703
Synonyms: N-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]norvalyl-4-chlorophenylalanine
Smiles: CCCC(C(=O)NC(C(=O)O)Cc1ccc(cc1)Cl)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
STK571704
Synonyms: N-cyclopropyl-2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)NC1CC1
STK571705
Synonyms: N-(2-tert-butylphenyl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C(C)(C)C)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1
STK571707
Synonyms: 2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1c1cccc(c1)C
STK571708
Synonyms: 2',6'-dihydroxy-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',8-dione
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2
STK571710
Synonyms: 2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(C)C)CSc1nnc(n1c1ccccc1)c1ccccn1
STK571711
Synonyms: 4-(4-chlorophenyl)-1-(4-fluorophenyl)-N-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Fc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccc(cc1)C)cc3c1ccc(cc1)Cl
STK571715
Synonyms: 4-acetyl-N-[(3Z)-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CC(Cn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)C(=O)C)/c2c1nc1ccccc1c2)C
STK571716
Synonyms: (3R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-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: CC([C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)F)C(=O)Nc1c2cccc1)C
STK571717
Synonyms: 2-{[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CCN(Cc2cc1OC)S(=O)(=O)c1cc(ccc1Cl)C(F)(F)F
STK571720
Synonyms: N-(2-chlorobenzyl)-4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NCc1ccccc1Cl
STK571721
Synonyms: 2,7-bis(4-chlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1ccc(cc1)Cl
STK571722
Synonyms: 4,5,6-trimethoxy-N-[3-(morpholin-4-yl)propyl]-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)NCCCN1CCOCC1
STK571724
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccccc1C(F)(F)F
STK571725
Synonyms: propyl[4-(dimethylamino)phenyl][hydroxy(2-methoxyphenyl)methyl]phosphinate
Smiles: CCCOP(=O)(C(c1ccccc1OC)O)c1ccc(cc1)N(C)C
STK571726
Synonyms: 3-(3-hydroxypropyl)-8-(4-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)OC
STK571728
Synonyms: 3-amino-N-[2-(1H-indol-3-yl)ethyl]-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
Smiles: Cc1cc(C)c2c(n1)sc(c2N)C(=O)NCCc1c[nH]c2c1cccc2
STK571729
Synonyms: 8-(3-methoxyphenyl)-1-methyl-3-(2-methylpropyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC(C)C
STK571730
Synonyms: N-butyl-1-({1-[(4-methylphenyl)sulfonyl]piperidin-4-yl}carbonyl)-L-prolinamide
Smiles: CCCCNC(=O)[C@@H]1CCCN1C(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C
STK571731
Synonyms: (1S,2S)-N'-{(E)-[3-(naphthalen-1-ylmethoxy)phenyl]methylidene}-2-phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cccc(c1)OCc1cccc2c1cccc2
STK571734
Synonyms: 6-amino-3-methyl-4-(3-methyl-1-phenyl-1H-pyrazol-4-yl)-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cn(nc1C)c1ccccc1)c(C)nn2c1ccccc1
STK571735
Synonyms: 4-[({[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl
STK571736
Synonyms: 4-methyl-6-oxo-6H-benzo[c]chromen-3-ylN-[(benzyloxy)carbonyl]-L-isoleucinate
Smiles: CC[C@H]([C@@H](C(=O)Oc1ccc2c(c1C)oc(=O)c1c2cccc1)NC(=O)OCc1ccccc1)C
STK571737
Synonyms: 2-(2-chloro-6-fluorophenyl)-N-[(2Z)-5,5-dioxido-3-(prop-2-en-1-yl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: C=CCN1/C(=N/C(=O)Cc2c(F)cccc2Cl)/SC2C1CS(=O)(=O)C2
STK571739
Synonyms: N-[2-(3,4-dimethylphenyl)-4-(4-methoxyphenyl)-6-methyl-5-oxo-2,5-dihydropyridazin-3-yl]furan-2-carboxamide
Smiles: COc1ccc(cc1)c1c(NC(=O)c2ccco2)n(nc(c1=O)C)c1ccc(c(c1)C)C
STK571740
Synonyms: 5-benzyl-2-[4-(diphenylmethyl)piperazin-1-yl]-6-methylpyrimidin-4-ol
Smiles: Cc1nc(nc(c1Cc1ccccc1)O)N1CCN(CC1)C(c1ccccc1)c1ccccc1
STK571741
Synonyms: 1-(3,4-dimethoxyphenyl)-2,7-dimethyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(ccc1OC)C1N(C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C
STK571744
Synonyms: 8-chloro-2,2,5-trimethyl-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)ncnc3Cl
STK571745
Synonyms: (3S,3a'R,8a'S,8b'S)-5-chloro-7-methyl-2'-[2-(trifluoromethyl)phenyl]-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)c1ccccc1C(F)(F)F
STK571748
Synonyms: N-[(2Z)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]-2-methylbutanamide
Smiles: CCC(C(=O)/N=c/1\sc2c([nH]1)ccc(c2)OC)C
STK571749
Synonyms: 2-(4-fluorophenyl)-10-methyl-3-(4-methylphenyl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: Cc1ccc(cc1)n1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccc(cc1)F
STK571750
Synonyms: (3a'S,6a'R)-5'-tert-butyl-7-chloro-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: CC(C1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1Cl)C
STK571752
Synonyms: 2-({4-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methylphenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C)nnc1COc1ccc(cc1)C
STK571753
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(4-propoxyphenyl)carbonyl]-3'-(pyridin-2-ylcarbonyl)-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)c2ccccn2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2
STK571754
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)OC)nnc1COc1ccc(cc1)Cl
STK571755
Synonyms: 3-[(3-fluorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
Smiles: Fc1cccc(c1)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C
STK571757
Synonyms: 7-(3-hydroxypropyl)-1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCCn1c(CN2CCCCC2C)nc2c1c(=O)n(c(=O)n2C)C
STK571758
Synonyms: N-(biphenyl-2-yl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1c1ccccc1)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1
STK571759
Synonyms: 2-(4-fluoro-2-nitrophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)c1ccc(cc1[N+](=O)[O-])F
STK571760
Synonyms: 4-hydroxy-3,6,6-trimethyl-N-[4-(propan-2-yl)phenyl]-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: O=C(c1oc2c(c1C)C(O)CC(C2)(C)C)Nc1ccc(cc1)C(C)C