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STK592060
Synonyms: 6'-chloro-1,3-diethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CCN1C(=O)N(CC)C(=O)C2(C1=O)Cc1c(Cl)cccc1N1C2CCC1

STK592061
Synonyms: N-(2,3-dimethylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]furan-2-carboxamide
Smiles: O=C(N(c1cccc(c1C)C)Cc1cc2ccccc2[nH]c1=O)c1ccco1

STK592062
Synonyms: 2-{5-[(3-methylbenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cc1ccc(cc1)n1c(SCc2cccc(c2)C)nnc1c1ccccn1

STK592063
Synonyms: N-(4-chloro-2-methylphenyl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)Cl)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK592064
Synonyms: N-(3-acetylphenyl)-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)CCCn1cnc2c(c1=O)cccc2

STK592066
Synonyms: 11-(furan-2-yl)-2-(4-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccc(cc1)c1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1

STK592067
Synonyms: 8-(4-benzylpiperidin-1-yl)-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1n(C)c2nc(n(c2c(=O)n1C)Cc1cccc2c1cccc2)N1CCC(CC1)Cc1ccccc1

STK592069
Synonyms: 9-(4-fluorophenyl)-6-(2-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Fc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1O

STK592071
Synonyms: 8-(3-chlorophenyl)-4-hydroxy-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Clc1cccc(c1)n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK592072
Synonyms: N-(2,5-dimethoxybenzyl)-2-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(prop-2-en-1-yl)acetamide
Smiles: C=CCN(C(=O)CN1C(=O)c2c(S1(=O)=O)cccc2)Cc1cc(OC)ccc1OC

STK592075
Synonyms: 4-{[(E)-(2,3-dichlorophenyl)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/c1cccc(c1Cl)Cl

STK592076
Synonyms: 8-(3-chlorophenyl)-11-(4-methoxyphenyl)-10-methyl-2-(pyridin-3-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1cccnc1)c1cccc(c1)Cl

STK592077
Synonyms: 5-[3-(benzyloxy)phenyl]-N'-[(E)-(3-methoxyphenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1

STK592078
Synonyms: 3-methyl-11-(4-methylphenyl)-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-1-ol
Smiles: CC1CC(=C2C(=Nc3ccccc3NC2c2ccc(cc2)C)C1)O

STK592080
Synonyms: (10aS)-2-[4-chloro-2-(trifluoromethyl)phenyl]-10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione
Smiles: Clc1ccc(c(c1)C(F)(F)F)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK592081
Synonyms: 3-(4-tert-butylphenyl)-4-phenyl-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazole
Smiles: CC(c1ccc(cc1)c1nnc(n1c1ccccc1)SCc1cccc(c1)C(F)(F)F)(C)C

STK592082
Synonyms: 4-({S-benzyl-N-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-D-cysteinyl}amino)butanoicacid
Smiles: O=C(N[C@@H](C(=O)NCCCC(=O)O)CSCc1ccccc1)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2

STK592084
Synonyms: 4-{[(E)-(5-methylthiophen-2-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/c1ccc(s1)C)C

STK592085
Synonyms: (4E)-5-(3,4-dimethoxyphenyl)-4-[hydroxy(4-methylphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1OC)C1NC(=O)C(=O)/C/1=C(\c1ccc(cc1)C)/O

STK592086
Synonyms: 4-{(2E)-2-[(2-methyl-1H-indol-3-yl)methylidene]hydrazinyl}-5-phenylthieno[2,3-d]pyrimidine
Smiles: Cc1[nH]c2c(c1/C=N/Nc1ncnc3c1c(cs3)c1ccccc1)cccc2

STK592087
Synonyms: 1-(3-methoxypropyl)-9-methyl-2-[(4-methylpiperidin-1-yl)carbonyl]pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)N1CCC(CC1)C

STK592088
Synonyms: 1-{N-[(5-methyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetyl]-beta-alanyl}piperidine-4-carboxylicacid
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1)NCCC(=O)N1CCC(CC1)C(=O)O

STK592092
Synonyms: (E)-[3-fluoro-4-(propan-2-yloxy)phenyl]{2-(5-methylfuran-2-yl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: Cc1ccc(o1)C1/C(=C(/c2ccc(c(c2)F)OC(C)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

STK592093
Synonyms: N-(2-methoxyethyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: COCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK592094
Synonyms: 2-[9-(4-fluorophenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetamide
Smiles: NC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)F

STK592095
Synonyms: 6-benzyl-2-hydroxy-1-(2-methylphenyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1ccccc1n1c(O)nc(=O)c2c1NCN(C2)Cc1ccccc1

STK592096
Synonyms: 1-(2-chlorobenzyl)-6-cyclohexyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(S)n(c2c1CN(CN2)C1CCCCC1)Cc1ccccc1Cl

STK592097
Synonyms: 8-[4-(2,5-dimethylbenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-(2-methylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1cc(C)ccc1C)C

STK592098
Synonyms: N-(3-fluoro-4-methylphenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK592101
Synonyms: N-(3-chloro-2-methylphenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1C)Cl)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK592103
Synonyms: 4-(3-chloro-4-fluorophenyl)-5-(thiophen-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1Cl)n1c(=S)[nH]nc1c1cccs1

STK592105
Synonyms: 2-(5-methoxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)-N-(4-sulfamoylbenzyl)acetamide
Smiles: COc1cc(C)cc2c1c(C)c(c(=O)o2)CC(=O)NCc1ccc(cc1)S(=O)(=O)N

STK592106
Synonyms: N-(3,4-dichlorophenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)Cl)nnc1COc1ccc(cc1)C

STK592108
Synonyms: 4-{[(E)-(3,4-dichlorophenyl)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/c1ccc(c(c1)Cl)Cl)C

STK592111
Synonyms: 6-(furan-2-ylmethyl)-1-(pyridin-3-ylmethyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(S)n(c2c1CN(CN2)Cc1ccco1)Cc1cccnc1

STK592112
Synonyms: (1'S,3R,3'S,7a'S)-1'-[(2-ethoxyphenyl)carbonyl]-7''-methyl-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCOc1ccccc1C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1C

STK592113
Synonyms: 9-(3,5-dimethylphenyl)-3-(4-fluorobenzyl)-7-hydroxy-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: OC1CN(c2cc(C)cc(c2)C)c2n(C1)c1c(=O)n(Cc3ccc(cc3)F)c(=O)n(c1n2)C

STK592115
Synonyms: N-(3-bromophenyl)-2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Br)nnc1COc1ccccc1

STK592117
Synonyms: 4-{[(E)-(4-bromophenyl)methylidene]amino}-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)Br

STK592120
Synonyms: 3-(4-ethoxyphenyl)-2-[(3-methylbenzyl)sulfanyl]quinazolin-4(3H)-one
Smiles: CCOc1ccc(cc1)n1c(SCc2cccc(c2)C)nc2c(c1=O)cccc2

STK592122
Synonyms: 4-{(2E)-2-[(1-benzyl-3,5-dimethyl-1H-pyrazol-4-yl)methylidene]hydrazinyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)N/N=C/c1c(C)nn(c1C)Cc1ccccc1

STK592123
Synonyms: (2E)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diphenylmethyl)-3-hydroxybut-2-en-1-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)/C(=C(/O)\C)/C(c1ccccc1)c1ccccc1

STK592124
Synonyms: 5-butyl-3-cycloheptyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-ylpentanoate
Smiles: CCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCC)cccc3)C1CCCCCC1

STK592125
Synonyms: (4E)-1-(furan-2-ylmethyl)-4-[hydroxy(3-nitrophenyl)methylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)C1N(Cc2ccco2)C(=O)C(=O)/C/1=C(\c1cccc(c1)[N+](=O)[O-])/O

STK592127
Synonyms: 9-(4-fluorophenyl)-1,7-dimethyl-3-(2-phenylethyl)-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)CCc1ccccc1

STK592128
Synonyms: 2-ethyl-1-[(2E)-2-(4-hydroxy-3-methoxybenzylidene)hydrazinyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1ccc(c(c1)OC)O)c1ccccc1n2

STK592129
Synonyms: 4-{[(E)-(2,3-dichlorophenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1cccc(c1Cl)Cl

STK592130
Synonyms: 4-(4-chlorophenyl)-3-[(3-methoxybenzyl)sulfanyl]-5-(3-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1cccc(c1)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)OC

STK592132
Synonyms: 3-(3-chlorophenyl)-5-[(4-methoxybenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK592134
Synonyms: 5,7-dichloro-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)c(Cl)cc(c1)Cl

STK592135
Synonyms: 6-ethyl-2-(ethylsulfanyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: CCSc1nc2n(n1)c(O)c(c(n2)C)CC

STK592136
Synonyms: (4E)-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1O)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1cccc(c1)[N+](=O)[O-]

STK592141
Synonyms: N-[4-(4-methoxyphenyl)-6-methyl-5-oxo-2-phenyl-2,5-dihydropyridazin-3-yl]-4-methylbenzamide
Smiles: COc1ccc(cc1)c1c(=O)c(C)nn(c1NC(=O)c1ccc(cc1)C)c1ccccc1

STK592142
Synonyms: 4-chloro-N-(furan-2-ylmethyl)-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)Cc1ccco1

STK592143
Synonyms: 1'-(2,5-dimethoxyphenyl)-3-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(c(c1)N1C(=O)NC(=O)C2(C1=O)Cc1ccccc1N1C2CN(C)CC1)OC

STK592144
Synonyms: N-[4-(diethylamino)phenyl]-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccccn1)CC

STK592145
Synonyms: N-(5-chloro-2-methylphenyl)-2-{[4-(4-chlorophenyl)-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccccc1c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1cc(Cl)ccc1C

STK592146
Synonyms: (5Z)-1-(2-methoxyphenyl)-5-(5-phenylpyrazolidin-3-ylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccccc1N1C(=O)NC(=O)/C(=C\2/NNC(C2)c2ccccc2)/C1=O

STK592148
Synonyms: N-[4-(4-oxo-3,4-dihydro-2H-1,3-benzoxazin-2-yl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)C1NC(=O)c2c(O1)cccc2

STK592149
Synonyms: N,N-dibutyl-2-{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)OC)CCCC

STK592154
Synonyms: (3S,3a'R,8a'S,8b'S)-7-chloro-2'-(2,3-dihydro-1,4-benzodioxin-6-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: O=C1N(c2ccc3c(c2)OCCO3)C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1cccc2Cl

STK592155
Synonyms: methyl3-[8-(2-methoxyphenyl)-1,7-dimethyl-2,4-dioxo-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]propanoate
Smiles: COC(=O)CCn1c(=O)c2n3cc(n(c3nc2n(c1=O)C)c1ccccc1OC)C

STK592156
Synonyms: 2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dibromo-4-methylphenyl)acetamide
Smiles: O=C(Nc1c(Br)cc(cc1Br)C)CSc1nnc(n1C)c1cccc(c1)Cl

STK592157
Synonyms: 7-chloro-3-(2-fluorophenyl)-1',3'-dimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1c(Cl)cccc1N1C2CN(CC1)c1ccccc1F

STK592158
Synonyms: (1S,2S)-N'-[(E)-(2-chlorophenyl)methylidene]-2-phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1ccccc1Cl

STK592161
Synonyms: 3-(4-chlorophenyl)-8-[(2,6-dimethylmorpholin-4-ium-4-yl)methyl]-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: CC1C[NH+](CC(O1)C)Cc1c([O-])ccc2c1oc(c(c2=O)c1ccc(cc1)Cl)C(F)(F)F

STK592162
Synonyms: N-[4-(acetylamino)phenyl]-2-({4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nnc1COc1ccc(cc1)C

STK592165
Synonyms: 2-(4-methylphenyl)-3-phenyl-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: Cc1ccc(cc1)c1nc2oc3ccccc3c(=O)c2c(=O)n1c1ccccc1

STK592166
Synonyms: 8-[(2,6-dimethylmorpholin-4-yl)methyl]-6-hydroxy-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC1CN(CC(O1)C)Cc1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C

STK592168
Synonyms: N-[(2Z)-5-(ethylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide
Smiles: CCSc1n[nH]/c(=N/C(=O)C2OC(=O)c3c(C2)cccc3)/s1

STK592170
Synonyms: (4E)-4-{[(3-methylbutyl)amino]methylidene}-2-phenylisoquinoline-1,3(2H,4H)-dione
Smiles: CC(CCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccccc1)C

STK592171
Synonyms: N-[2-(morpholin-4-yl)ethyl]-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-amine
Smiles: CC(c1nc2oc3c(c2c2c1CCC2)ncnc3NCCN1CCOCC1)C

STK592173
Synonyms: N-[3-(4-bromophenyl)-4-oxo-4H-chromen-2-yl]furan-2-carboxamide
Smiles: Brc1ccc(cc1)c1c(NC(=O)c2ccco2)oc2c(c1=O)cccc2

STK592174
Synonyms: 8-hydrazinyl-2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: NNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C(C)C

STK592175
Synonyms: (4E)-6-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-4-(phenylimino)-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Nc1nc(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)[nH]/c(=N\c2ccccc2)/n1

STK592176
Synonyms: 1-(4-tert-butylphenyl)-7-chloro-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(C1c1ccc(cc1)C(C)(C)C)c1noc(c1)C

STK592177
Synonyms: (5Z)-1-(4-fluorophenyl)-5-{[1-(2-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)c2ccccc2F)C)/C1=O)S

STK592178
Synonyms: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(4-bromophenyl)-4H-imidazol-5-ol
Smiles: Brc1ccc(cc1)C1=N/C(=C\c2ccc3c(c2)OCO3)/C(=N1)O

STK592180
Synonyms: 6-ethyl-10-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-yl)-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: CCc1cc(=O)oc2c1cc1CN(COc1c2C)C1CCCc2c1cccc2

STK592181
Synonyms: 5-tert-butyl-3-(2-chlorophenyl)-7-hydrazinyl-2-methylpyrazolo[1,5-a]pyrimidine
Smiles: NNc1cc(nc2n1nc(c2c1ccccc1Cl)C)C(C)(C)C

STK592183
Synonyms: 6-benzyl-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidine-7-thiol
Smiles: Cc1nc2n(c(c1Cc1ccccc1)S)nc(c2c1ccccc1)C

STK592184
Synonyms: 2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-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)nnc1Cc1cccs1

STK592185
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-fluorophenyl)acetamide
Smiles: O=C(Nc1cccc(c1)F)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK592186
Synonyms: N-(3-chlorophenyl)-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Cl)nnc1COc1ccccc1

STK592187
Synonyms: 3-[(3a'S,6a'R)-5'-(4-fluorobenzyl)-7-methyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanamide
Smiles: NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccc(cc1)F)C(=O)Nc1c2cccc1C

STK592189
Synonyms: methyl(2-bromo-4,6-dimethyl-1-benzofuran-3-yl)acetate
Smiles: COC(=O)Cc1c(Br)oc2c1c(C)cc(c2)C

STK592191
Synonyms: ethyl[7-hydroxy-2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]acetate
Smiles: CCOC(=O)Cc1cc(O)n2c(n1)cc(n2)c1ccc(cc1)C

STK592192
Synonyms: 9-methyl-3-{(Z)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2)/C(=O)N1CC1CCCO1

STK592196
Synonyms: 6-hydroxy-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-8-(piperazin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCNCC1)COc1cccc(c1)C

STK592197
Synonyms: 2-(2-methylphenyl)-7-(3-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1cccc(c1)n1ncc2c1ncn1c2nc(n1)c1ccccc1C

STK592198
Synonyms: 8-methoxy-3-(4-methoxybenzyl)-2-(4-methylphenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COc1ccc(cc1)Cn1c(nc2c(c1=O)c(=O)c1c(o2)cc(cc1)OC)c1ccc(cc1)C

STK592199
Synonyms: N-(2,4-dimethoxyphenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK592200
Synonyms: 5-methyl-N-[3-(propan-2-yloxy)propyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CC(OCCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCCC2)C

STK592202
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-cyanophenyl)ethylidene]-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)C#N)\C

STK592203
Synonyms: 7-chloro-1-phenyl-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1)Cc1cccnc1

STK592204
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone
Smiles: Cc1ccc(cc1)C(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK592207
Synonyms: (1S,2S)-N'-[(E)-(2-chloro-6-methoxyquinolin-3-yl)methylidene]-2-phenylcyclopropanecarbohydrazide
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)/C=N/NC(=O)[C@H]1C[C@@H]1c1ccccc1

STK592208
Synonyms: (3S)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C([C@H]1NCc2c(C1)cccc2)NC1CCCc2c1cccc2

STK592209
Synonyms: N-(4-bromo-2-methylphenyl)-2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)Br)CSc1nnc(n1C)c1cccc(c1)Cl

STK592212
Synonyms: 2-(5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)-N-(3-phenylpropyl)acetamide
Smiles: O=C(Cn1c2ccccc2c2c1c(=O)n1CCSc1n2)NCCCc1ccccc1

STK592214
Synonyms: 4-imino-2-phenyl-N-(2-phenylethyl)-6,7,11,12-tetrahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-3-carboxamide
Smiles: O=C(c1c(cc2n(c1=N)CCc1c2cc2OCCCOc2c1)c1ccccc1)NCCc1ccccc1

STK592215
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-6-(3-chloro-4-fluorophenyl)-3-(3,4-dimethoxyphenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: COc1cc(ccc1OC)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

STK592216
Synonyms: 2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STK592217
Synonyms: (4E)-2-(2-methoxyphenyl)-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccccc1N1C(=O)/C(=C/NCCCN2CCOCC2)/c2c(C1=O)cccc2

STK592219
Synonyms: (2E,5Z)-2-[(2,4-dichlorophenyl)imino]-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-2,5-dihydro-1,3-thiazol-4-ol
Smiles: Clc1ccc(c(c1)Cl)/N=C\1/S/C(=C\c2cccn2C)/C(=N1)O

STK592220
Synonyms: (4E)-1-(furan-2-ylmethyl)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)Cc1ccco1)/O

STK592221
Synonyms: 3-phenyl-1'-(propan-2-yl)-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: CC(N1C(=O)NC(=O)C2(C1=O)Cc1ccccc1N1C2CN(CC1)c1ccccc1)C

STK592224
Synonyms: N-[(1Z)-1-{1-cyano-2-[(3-methylbutyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1)/C(=O)NCCC(C)C

STK592225
Synonyms: 6-methyl-9-(pyridin-2-ylmethyl)-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c2c1CCC2)Cc1ccccn1

STK592226
Synonyms: 2-[3-(furan-2-ylmethyl)-4-imino-6,6-dimethyl-2-oxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl]-N-(3-methylphenyl)acetamide
Smiles: O=C(Cn1c(=O)n(Cc2ccco2)c(=N)c2c1sc1c2CC(OC1)(C)C)Nc1cccc(c1)C

STK592227
Synonyms: 4-(4-chlorophenyl)-3-(4-methoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCc1ccc(cc1)[N+](=O)[O-]

STK592229
Synonyms: 4-{[(2'S,3S,3'S,10b'R)-2'-(furan-2-ylcarbonyl)-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl]carbonyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)cccc3

STK592230
Synonyms: 1,1'-{[2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl]imino}dipropan-2-ol
Smiles: CC(CN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C(C)C)CC(O)C)O

STK592231
Synonyms: 6-(4-methoxyphenyl)-10-methyl-3-(pyridin-2-ylmethyl)-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1cc1CN(COc1c2C)Cc1ccccn1

STK592232
Synonyms: N-(2-methoxy-5-methylphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2OC)nnc1c1ccccn1

STK592234
Synonyms: N-[(1Z)-1-{1-cyano-2-[(furan-2-ylmethyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-2-methylbenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1C)/C(=O)NCc1ccco1

STK592235
Synonyms: ethyl2-{[(Z)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C\2/C(=NC(=NC2=O)S)O)sc2c1CCC2

STK592236
Synonyms: N-[(2Z)-3-(2-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methoxyacetamide
Smiles: COCC(=O)/N=C/1\SC2C(N1c1ccccc1F)CS(=O)(=O)C2

STK592238
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-chlorophenyl)carbonyl]-2'-[(3-fluoro-4-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1F)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK592239
Synonyms: 9-(2-methylphenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: OC1=C2C(=Nc3n(C2c2ccccc2C)ncn3)CC(C1)c1ccccc1

STK592241
Synonyms: N-(2-ethoxyphenyl)-2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2OCC)nnc1c1cccc(c1)C

STK592242
Synonyms: 3-(4-chlorophenyl)-8-[(dimethylammonio)methyl]-2-methyl-4-oxo-4H-chromen-7-olate
Smiles: C[NH+](Cc1c([O-])ccc2c1oc(C)c(c2=O)c1ccc(cc1)Cl)C

STK592243
Synonyms: 1-(3-nitrophenyl)-2-[6-(propan-2-yl)-1,3-benzothiazol-2-yl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CC(c1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)cccc1)C

STK592245
Synonyms: 4-(4-chlorophenyl)-1-(4-ethylphenyl)-N-(3-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)OC)cc3c1ccc(cc1)Cl

STK592246
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2F)nnc1c1ccccn1

STK592247
Synonyms: 5,10,10-trimethyl-2-(4-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)c1ccc(cc1)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2

STK592250
Synonyms: (6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)[4-(trifluoromethoxy)phenyl]methanone
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)c1ccc(cc1)OC(F)(F)F

STK592252
Synonyms: N-(2-bromophenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1cnc2c(c1=O)cccc2)Nc1ccccc1Br

STK592255
Synonyms: (4E)-4-[furan-2-yl(hydroxy)methylidene]-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: CSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccc(cc1)C(C)C

STK592256
Synonyms: 2-{4-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-phenylpyrimidin-4-yl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1cc(nc(n1)n1nc(cc1C)C)c1ccccc1

STK592257
Synonyms: 3-{[(E)-(4-butoxyphenyl)methylidene]amino}-2-hydroxy-7-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCCCOc1ccc(cc1)/C=N/n1c(O)nc2c(c1=O)[nH]c1c2ccc(c1)OC

STK592258
Synonyms: 4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1Br)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK592259
Synonyms: 4-{[(E)-(3-ethoxy-2-hydroxyphenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1O)/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC

STK592260
Synonyms: (5Z)-5-[(2E)-3-(2,4-dimethoxyphenyl)-1-hydroxyprop-2-en-1-ylidene]-6-hydroxy-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C(\C=C\c2ccc(cc2OC)OC)/O)/C1=O)O

STK592261
Synonyms: (2Z)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-oxo-2-[(2E)-3-phenylprop-2-en-1-ylidene]-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\C=C\c1ccccc1)/C2=O

STK592262
Synonyms: 5-(2-bromophenyl)-4-{[(E)-(3-ethoxy-2-hydroxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1O)/C=N/n1c(=S)[nH]nc1c1ccccc1Br

STK592263
Synonyms: N-(3-methylphenyl)-4-phenyl-1-[4-(propan-2-yl)phenyl]-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1c(c2ccc(cc2)C(C)C)c2c3n1cc(n3CCCC2)c1ccccc1

STK592265
Synonyms: 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}-N-(3-methylphenyl)acetamide
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCC(=O)Nc3cccc(c3)C)nnc2c2c1CC(C)(C)OC2

STK592267
Synonyms: 8-(4-methoxybenzyl)-1,7-dimethyl-3-(2-methylpropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CC(C)C

STK592268
Synonyms: 2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1H-indazol-6-yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)[nH]nc2)CSc1nnc(n1C)c1cccc(c1)Cl

STK592269
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(2,5-dimethoxyphenyl)carbonyl]-3'-(pyridin-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccn2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)OC

STK592270
Synonyms: 4-(benzylsulfanyl)-2-(3-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: COc1cccc(c1)c1nc(SCc2ccccc2)c2c(n1)CC(OC2)(C)C

STK592272
Synonyms: 8-hydrazinyl-2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: NNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C

STK592274
Synonyms: N-(3-ethoxypropyl)-2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CCOCCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CCC

STK592277
Synonyms: 1-(4-ethoxy-3-methoxyphenyl)-7-methyl-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1OC)C1N(c2sc3c(n2)ccc(c3)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK592278
Synonyms: (5Z)-6-hydroxy-5-[(2E)-1-hydroxy-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-ylidene]-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C(\C=C\c2cc(OC)c(c(c2)OC)OC)/O)/C1=O)O

STK592279
Synonyms: (4E)-5-[3-(benzyloxy)phenyl]-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1c1nnc(s1)SCc1ccccc1Cl)c1cccc(c1)OCc1ccccc1

STK592280
Synonyms: 3-(2,4-dimethylphenyl)-1'-ethyl-6-hydroxy-6'-nitro-2'-phenyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: CCN1c2ccc(cc2CC2(C1c1ccccc1)C(=NC(=O)N(C2=O)c1ccc(cc1C)C)O)[N+](=O)[O-]

STK592281
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-7-methyl-1-(3,4,5-trimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1c(OC)cc(cc1OC)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK592283
Synonyms: (4E)-2-(2,5-dimethoxyphenyl)-4-{[(3-methoxyphenyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: COc1cccc(c1)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1cc(OC)ccc1OC

STK592284
Synonyms: N-(4-methoxyphenyl)-2-(10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-ylsulfanyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CCCC3

STK592285
Synonyms: 2-methoxy-4-[(E)-{[3-(3-methylphenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]phenylacetate
Smiles: COc1cc(ccc1OC(=O)C)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK592286
Synonyms: 4-{[(E)-(3-hydroxyphenyl)methylidene]amino}-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)O

STK592290
Synonyms: 4-{[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]amino}-5-(4-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/C(=C/c1ccccc1)/Cl

STK592293
Synonyms: N-(4-bromophenyl)-2-{(2E)-4-hydroxy-2-[(2E)-(4-hydroxy-3-methoxybenzylidene)hydrazinylidene]-2,5-dihydro-1,3-thiazol-5-yl}acetamide
Smiles: COc1cc(/C=N/N=C\2/SC(C(=N2)O)CC(=O)Nc2ccc(cc2)Br)ccc1O

STK592294
Synonyms: 5-({2-[(5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)-2-hydroxybenzoicacid
Smiles: O=C(C(N1C(=S)S/C(=C\c2ccco2)/C1=O)C)Nc1ccc(c(c1)C(=O)O)O

STK592296
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3-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: COc1cccc(c1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)OC(C)C)C(=O)Nc1c2cccc1)cccc3

STK592297
Synonyms: 5-chloro-N-(3,4-dimethoxybenzyl)-N-(prop-2-en-1-yl)-1H-indole-2-carboxamide
Smiles: C=CCN(C(=O)c1cc2c([nH]1)ccc(c2)Cl)Cc1ccc(c(c1)OC)OC

STK592298
Synonyms: N-[(2E)-4-(4-methoxyphenyl)-1,3-thiazol-2(3H)-ylidene]-2-{[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1cs/c(=N/C(=O)CSc2snc(n2)SC)/[nH]1

STK592299
Synonyms: N-(3-fluorophenyl)-2-hydroxy-5-oxo-7-phenyl-3,4,5,6,7,8-hexahydroquinoline-4-carboxamide
Smiles: OC1=NC2=C(C(C1)C(=O)Nc1cccc(c1)F)C(=O)CC(C2)c1ccccc1

STK592300
Synonyms: 3-[2-(cyclohex-1-en-1-yl)ethyl]-7-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)[nH]c1c2ncn(c1=O)CCC1=CCCCC1

STK592301
Synonyms: (4E)-5-[4-(benzyloxy)-3-ethoxyphenyl]-1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccc(cc1)Cl

STK592302
Synonyms: 4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-(pyridin-2-yl)butanamide
Smiles: O=C(Nc1ccccn1)CCCn1nnc2c(c1=O)cccc2

STK592303
Synonyms: N-(3-chloro-2-methylphenyl)-2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1cccc(c1C)Cl)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK592304
Synonyms: 1-(2-chlorophenyl)-1'-methyl-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCC1N(C)c2ccc(cc2CC21C(=O)NC(=O)N(C2=O)c1ccccc1Cl)[N+](=O)[O-]

STK592305
Synonyms: (2E,5Z)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-2-{[3-(trifluoromethyl)phenyl]imino}-2,5-dihydro-1,3-thiazol-4-ol
Smiles: OC1=N/C(=N\c2cccc(c2)C(F)(F)F)/S/C/1=C\c1cccn1C

STK592306
Synonyms: 5-[(3-chloro-4,5-dimethoxybenzyl)amino]-2-(morpholin-4-ium-4-yl)benzoate
Smiles: COc1c(Cl)cc(cc1OC)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK592307
Synonyms: 2-(6-ethoxy-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)OC)c(=O)c1c(o2)ccc(c1)C

STK592309
Synonyms: N-[1-(4-methoxybenzyl)-5-oxo-2-phenyl-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]acetamide
Smiles: COc1ccc(cc1)CN1C(=NC(C1=O)(NC(=O)C)C(F)(F)F)c1ccccc1

STK592311
Synonyms: (2S)-N-(1,3-benzodioxol-5-yl)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CC([C@H](n1nnc2c(c1=O)cccc2)C(=O)Nc1ccc2c(c1)OCO2)C

STK592313
Synonyms: N-[2-(dimethylamino)ethyl]-4-methyl-3-[4-(propan-2-yloxy)phenyl]pentanamide
Smiles: CN(CCNC(=O)CC(c1ccc(cc1)OC(C)C)C(C)C)C

STK592314
Synonyms: 3-[(3a'S,6a'R)-7-chloro-5'-cyclohexyl-5-methyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanoicacid
Smiles: OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C1CCCCC1)C(=O)Nc1c2cc(C)cc1Cl

STK592315
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(furan-2-yl)-1-(2-phenylethyl)pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1CCc1ccccc1)c1ccco1

STK592317
Synonyms: 3-(phenylsulfonyl)-1-(tetrahydrofuran-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: Nc1n(CC2CCCO2)c2c(c1S(=O)(=O)c1ccccc1)nc1c(n2)cccc1

STK592318
Synonyms: N-(2,6-dimethylphenyl)-2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nnc1c1cccc(c1)C

STK592322
Synonyms: 2-{[7,7-dimethyl-2-(3-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethanone
Smiles: Cc1cccc(c1)c1nc(SCC(=O)N2CCCC2)c2c(n1)CC(OC2)(C)C

STK592323
Synonyms: 1-ethyl-2-methyl-1'-(4-methylbenzyl)-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)NC(=O)N(C2=O)Cc1ccc(cc1)C

STK592324
Synonyms: 7-(2,3-dihydroxypropyl)-1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCC(Cn1c(CN2CCCCC2C)nc2c1c(=O)n(c(=O)n2C)C)O

STK592325
Synonyms: 4-[(Z)-(4-iminio-2-oxo-2H-pyrimido[2,1-b][1,3]benzothiazol-3(4H)-ylidene)methyl]-2-methoxyphenolate
Smiles: COc1cc(ccc1[O-])/C=C/1\C(=O)N=c2n(C1=[NH2+])c1ccccc1s2

STK592326
Synonyms: 5-(3,4-dimethoxyphenyl)-7-hydroxy-1-methyl-2-(methylsulfanyl)-5,6-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: COc1cc(ccc1OC)C1CC(=Nc2c1c(=O)nc(n2C)SC)O

STK592333
Synonyms: 8-(cyclohexylamino)-6-hydroxy-7-[2-hydroxy-3-(propan-2-yloxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(NC2CCCCC2)nc2c1c(O)nc(=O)n2C)COC(C)C

STK592335
Synonyms: 2-(6-ethyl-1,3-benzothiazol-2-yl)-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)[N+](=O)[O-])c(=O)c1c(o2)cccc1

STK592336
Synonyms: 5-(azepan-1-yl)-2-(1H-benzimidazol-2-yl)-4-chloropyridazin-3(2H)-one
Smiles: Clc1c(cnn(c1=O)c1nc2c([nH]1)cccc2)N1CCCCCC1

STK592337
Synonyms: ethyl4-{(3aR,4R,4aR,7aS,8R,8aR)-3-[2-(cyanomethoxy)phenyl]-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}benzoate
Smiles: N#CCOc1ccccc1C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)C(=O)OCC

STK592339
Synonyms: (3aR,6aS)-5-(4-bromophenyl)-3-(2,3-dimethoxyphenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1cccc(c1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)Br

STK592340
Synonyms: 2-{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)OC)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)Cl

STK592342
Synonyms: (7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)(4-phenoxyphenyl)methanone
Smiles: O=C(N1CCc2c(C1C)cc1c(c2)OCCCO1)c1ccc(cc1)Oc1ccccc1

STK592343
Synonyms: tert-butyl(2-{5-[(4-methylbenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}ethyl)carbamate
Smiles: O=C(OC(C)(C)C)NCCc1nnc(o1)S(=O)(=O)Cc1ccc(cc1)C

STK592344
Synonyms: (4E)-1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxy-4-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK592345
Synonyms: N~2~-[(4-methylphenyl)sulfonyl]-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]methioninamide
Smiles: CSCCC(C(=O)NCCc1nnc2n1cccc2)NS(=O)(=O)c1ccc(cc1)C

STK592346
Synonyms: 4-methoxy-N-[4-(4-methoxyphenyl)-6-methyl-2-(4-methylphenyl)-5-oxo-2,5-dihydropyridazin-3-yl]benzamide
Smiles: COc1ccc(cc1)C(=O)Nc1n(nc(c(=O)c1c1ccc(cc1)OC)C)c1ccc(cc1)C

STK592348
Synonyms: (5E)-5-(1-{[4-(dimethylamino)phenyl]amino}ethylidene)-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C(\Nc2ccc(cc2)N(C)C)/C)/C1=O)O

STK592349
Synonyms: (4E)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3,4-diethoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK592350
Synonyms: N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)[1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: c1coc(c1)CN(c1ncnc2c1oc1c2cccc1)Cc1cccs1

STK592351
Synonyms: 5-iodofuran-2-carboxamide
Smiles: NC(=O)c1ccc(o1)I

STK592352
Synonyms: 4-fluoro-N-(2-methoxyethyl)-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COCCN(C(=O)c1ccc(cc1)F)Cc1cc2cccc(c2[nH]c1=O)C

STK592354
Synonyms: 1,6,7,8-tetramethyl-3-(3-phenylpropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: O=c1n(CCCc2ccccc2)c(=O)c2c(n1C)nc1n2c(C)c(n1C)C

STK592356
Synonyms: 6-ethyl-4-(3-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine
Smiles: CCc1sc2c(c1)c(ncn2)N1CCCC(C1)C

STK592357
Synonyms: 4-{[(E)-(5-methylthiophen-2-yl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccc(s1)C

STK592358
Synonyms: 4-(5,9-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-N,N-dimethylaniline
Smiles: CC1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)c1ccc(cc1)N(C)C

STK592360
Synonyms: (5Z)-5-(4-fluorobenzylidene)-3-{2-oxo-2-[2-(pyridin-3-yl)piperidin-1-yl]ethyl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: Fc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CC(=O)N1CCCCC1c1cccnc1

STK592364
Synonyms: 4-phenyl-9-(pyridin-4-ylmethyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: O=c1cc(c2ccccc2)c2c(o1)c1CN(COc1cc2)Cc1ccncc1

STK592365
Synonyms: (5Z)-1-(4-chlorophenyl)-5-[5-(3,4,5-trimethoxyphenyl)pyrazolidin-3-ylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1c(OC)cc(cc1OC)C1NN/C(=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)/C1

STK592366
Synonyms: 2-(3-chlorophenyl)-5-(4-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc(cc1)C1Oc2ccccc2C2N1N=C(C2)c1cccc(c1)Cl

STK592369
Synonyms: 7-chloro-1-{4-[(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(C1c1ccc(cc1)OCc1ccc(cc1)Cl)c(=O)c1c(o2)ccc(c1)Cl

STK592370
Synonyms: 8-[4-(2-chlorobenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(=C)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1Cl

STK592371
Synonyms: (5Z)-6-hydroxy-3-(2-methylphenyl)-5-{1-[(1-phenylethyl)amino]ethylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C(\NC(c1ccccc1)C)/C)c1ccccc1C

STK592372
Synonyms: 1-{2-[(4-methoxyphenoxy)methyl]-8-methyl-10-phenyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl}ethanone
Smiles: COc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)OC(=C(C1c1ccccc1)C(=O)C)C

STK592374
Synonyms: 7-tert-butyl-2-(pyridin-3-yl)-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Smiles: O=C1NC(Nc2c1c1CCC(Cc1s2)C(C)(C)C)c1cccnc1

STK592375
Synonyms: methyl4-{[({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK592376
Synonyms: 1-(4-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-phenylpyrimidin-4-yl]oxy}phenyl)ethanone
Smiles: Cc1nn(c(c1)C)c1nc(Oc2ccc(cc2)C(=O)C)cc(n1)c1ccccc1

STK592377
Synonyms: 1-(4-chlorophenyl)-2-hydroxy-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Clc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)C(C)C

STK592378
Synonyms: 4-{[(E)-(3-chlorophenyl)methylidene]amino}-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1

STK592379
Synonyms: (4E)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK592380
Synonyms: 4-{[(E)-(2-chlorophenyl)methylidene]amino}-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccccc1Cl

STK592382
Synonyms: 2-[(5Z)-5-(2-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[3-(1H-imidazol-1-yl)propyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2F)/C1=O)NCCCn1cncc1

STK592383
Synonyms: 3-(2,5-dimethoxyphenyl)-7-(2,6-dimethylphenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: COc1ccc(cc1C1=NOC2(C1)CC(=O)N(C2=O)c1c(C)cccc1C)OC

STK592385
Synonyms: 1-{[2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl]amino}propan-2-ol
Smiles: CC(CNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C(C)C)O

STK592386
Synonyms: N-(2-methoxyphenyl)-1,4-diphenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccccc1NC(=O)c1c(c2ccccc2)c2c3n1cc(n3CCCC2)c1ccccc1

STK592387
Synonyms: 5-[(2E)-3-(1-ethyl-1H-indol-3-yl)prop-2-enoyl]-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Smiles: CCn1cc(c2c1cccc2)/C=C/C(=O)c1c(O)n(C)c(=O)n(c1=O)C

STK592388
Synonyms: N-(phenylsulfonyl)phosphorodiamidicacid
Smiles: NP(=O)(NS(=O)(=O)c1ccccc1)O

STK592392
Synonyms: 7-chloro-1-(4-chlorophenyl)-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK592394
Synonyms: 8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl{[(4-methylphenyl)sulfonyl]amino}(phenyl)acetate
Smiles: COc1ccc2c(c1)c(=O)oc1c2ccc(c1C)OC(=O)C(c1ccccc1)NS(=O)(=O)c1ccc(cc1)C

STK592395
Synonyms: 7-chloro-2-(5-methyl-1,2-oxazol-3-yl)-1-(2,4,5-trimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(OC)c(cc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl)OC

STK592396
Synonyms: (2E)-2-cyano-2-[(5E)-5-(4-ethoxy-3-methoxybenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3-methoxyphenyl)ethanamide
Smiles: CCOc1ccc(cc1OC)/C=c\1/s/c(=C(/C(=O)Nc2cccc(c2)OC)\C#N)/n(c1=O)c1ccccc1

STK592397
Synonyms: 3-(3-hydroxypropyl)-1-methyl-8-(2-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C

STK592399
Synonyms: 3-butyl-5-{(2E)-3-[4-(diethylamino)phenyl]prop-2-enoyl}-2,6-dihydroxypyrimidin-4(3H)-one
Smiles: CCCCn1c(O)nc(c(c1=O)C(=O)/C=C/c1ccc(cc1)N(CC)CC)O

STK592401
Synonyms: (5Z)-3-cyclohexyl-6-hydroxy-5-{1-[(2-phenylethyl)amino]ethylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C(/NCCc2ccccc2)\C)/C(=O)N1C1CCCCC1

STK592402
Synonyms: 7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1cccc(c1Cn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C)Cl

STK592405
Synonyms: N-(2,4-difluorophenyl)-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: O=C(Nc1ccc(cc1F)F)CCCn1cnc2c(c1=O)cccc2

STK592408
Synonyms: 2-{[10-(2-methylpropyl)-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-1-phenylethanone
Smiles: CC(Cc1nc2sc3c(c2c2c1CCC2)ncn1c3nnc1SCC(=O)c1ccccc1)C

STK592411
Synonyms: 2-[3-(4-chlorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-cyclopropylacetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Cl)NC1CC1

STK592412
Synonyms: N-(3-chloro-4-methylphenyl)-2-{[3-cyano-4-(2-fluorophenyl)-6-hydroxy-4,5-dihydropyridin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)N=C(CC1c1ccccc1F)O

STK592413
Synonyms: 5-(4-ethoxyphenyl)-4-({(E)-[4-(pentyloxy)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCCCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)OCC

STK592414
Synonyms: 3-[(3a'S,6a'R)-5'-tert-butyl-5-chloro-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)C(C)(C)C)C(=O)Nc1c2cc(Cl)cc1

STK592417
Synonyms: (2Z)-7-{[bis(2-methoxyethyl)ammonio]methyl}-2-[4-(methoxycarbonyl)benzylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)C(=O)OC)/C2=O)CCOC

STK592418
Synonyms: (4Z)-4-[(2-methoxyphenyl)imino]-6-{[4-(3-methoxyphenyl)piperazin-1-yl]methyl}-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: COc1cccc(c1)N1CCN(CC1)Cc1nc(N)n/c(=N\c2ccccc2OC)/[nH]1

STK592419
Synonyms: N-(3,5-dimethoxyphenyl)-2-{[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2CC)c2ccccc2OC)cc(c1)OC

STK592421
Synonyms: 6'-amino-1,3',5-trimethyl-2-oxo-1'-phenyl-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31c1cc(C)ccc1N(C3=O)C)c(C)nn2c1ccccc1

STK592422
Synonyms: (3a'R,8b'S)-5-fluoro-2'-(2-methoxyethyl)-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: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(F)cc2

STK592423
Synonyms: (4Z)-4-(3-bromo-4-nitrobenzylidene)-2-(3-fluorophenyl)-1,3-oxazol-5(4H)-one
Smiles: Fc1cccc(c1)C1=N/C(=C\c2ccc(c(c2)Br)[N+](=O)[O-])/C(=O)O1

STK592426
Synonyms: N-[(3-bromophenyl)carbamoyl]-D-alanine
Smiles: O=C(N[C@@H](C(=O)O)C)Nc1cccc(c1)Br

STK592427
Synonyms: 8-(3,4-dimethylphenyl)-4-hydroxy-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purin-2(6H)-one
Smiles: Cc1ccc(cc1C)N1CCn2c1nc1c2c(O)nc(=O)n1C

STK592428
Synonyms: 5-(4-chlorophenyl)-4-{[(E)-(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cc(Br)cc(c1O)Br

STK592429
Synonyms: 8-(4-benzylpiperidin-1-yl)-6-hydroxy-3-methyl-7-(2-phenoxyethyl)-3,7-dihydro-2H-purin-2-one
Smiles: O=c1nc(O)c2c(n1C)nc(n2CCOc1ccccc1)N1CCC(CC1)Cc1ccccc1

STK592432
Synonyms: 6-methoxy-N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]-1H-indole-2-carbohydrazide
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)N/N=C/c1cc(OC)c(c(c1)OC)OC

STK592433
Synonyms: ethyl4-(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinolin-8-yl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1ncnc2c1oc1c2c2CCCCc2c(n1)CCC

STK592436
Synonyms: 3-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-8,8-dimethyl-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(SCc3nc4c([nH]3)cccc4)nnc2c2c1CC(C)(C)OC2

STK592437
Synonyms: N-(4-chloro-2-methoxy-5-methylphenyl)-2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(C)c(cc2OC)Cl)nnc1c1cccc(c1)OC

STK592438
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-(5-methylfuran-2-yl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(o1)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK592443
Synonyms: N'-[(E)-(6-chloro[1,3]dioxolo[4,5-g]quinolin-7-yl)methylidene]-4-methylbenzenesulfonohydrazide
Smiles: Cc1ccc(cc1)S(=O)(=O)N/N=C/c1cc2cc3OCOc3cc2nc1Cl

STK592444
Synonyms: 2-cyclohexyl-8-methoxy-3-(2-phenylethyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)c(=O)n(c(n1)C1CCCCC1)CCc1ccccc1

STK592445
Synonyms: N,1-bis(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)C)n2c3c1CCCCn3c(c2)c1ccccc1

STK592447
Synonyms: 4-({(E)-[4-(benzyloxy)phenyl]methylidene}amino)-5-(3-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)OCc1ccccc1

STK592448
Synonyms: 4-methyl-N-[(3Z)-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)C)/c2c1nc1ccccc1c2

STK592449
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-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)Cl

STK592450
Synonyms: 4-methyl-9-[2-(morpholin-4-yl)ethyl]-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: O=c1cc(C)c2c(o1)c1CN(CCN3CCOCC3)COc1cc2

STK592451
Synonyms: 3-(3-chlorophenyl)-5-[(2,6-difluorobenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
Smiles: Clc1cccc(c1)c1nnc(n1c1ccccc1)SCc1c(F)cccc1F

STK592452
Synonyms: 3-methoxy-N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]benzamide
Smiles: COc1cccc(c1)C(=O)Nc1oc2ccccc2c(=O)c1c1ccc(cc1)C

STK592453
Synonyms: 6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[4-(trifluoromethoxy)phenyl]hexanamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CCCCCn1nnc2c(c1=O)cccc2

STK592454
Synonyms: (5E)-6-hydroxy-5-(1-{[3-(1H-imidazol-1-yl)propyl]amino}ethylidene)-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C(\NCCCn2cncc2)/C)/C(=O)N1c1ccccc1C

STK592455
Synonyms: 4-bromo-N-(1-imino-1,3-dihydro-2H-isoindol-2-yl)benzamide
Smiles: Brc1ccc(cc1)C(=O)NN1Cc2c(C1=N)cccc2

STK592456
Synonyms: N-[(2E)-5,5-dioxido-3-(prop-2-en-1-yl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-4-phenylbutanamide
Smiles: C=CCN1/C(=N\C(=O)CCCc2ccccc2)/SC2C1CS(=O)(=O)C2

STK592457
Synonyms: (2E,5Z)-2-[(2-bromophenyl)imino]-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-2,5-dihydro-1,3-thiazol-4-ol
Smiles: OC1=N/C(=N\c2ccccc2Br)/S/C/1=C\c1cccn1C

STK592459
Synonyms: N-[4-(diethylamino)phenyl]-2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)c1ccccc1F)CC

STK592462
Synonyms: 2-methoxy-4-[(E)-{[3-(pyridin-3-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]phenylacetate
Smiles: COc1cc(ccc1OC(=O)C)/C=N/n1c(=S)[nH]nc1c1cccnc1

STK592463
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(3-propoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK592464
Synonyms: 2-{5-[(2-methylbenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cc1ccc(cc1)n1c(nnc1c1ccccn1)SCc1ccccc1C

STK592465
Synonyms: 3-(3-butoxypropyl)-7-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCCCOCCCn1cnc2c(c1=O)[nH]c1c2ccc(c1)C

STK592469
Synonyms: N-[1-methyl-3-(naphthalen-1-yl)-4-oxo-1,4-dihydroquinolin-2-yl]thiophene-2-carboxamide
Smiles: O=C(c1cccs1)Nc1c(c(=O)c2c(n1C)cccc2)c1cccc2c1cccc2

STK592471
Synonyms: 8-methoxy-3-(2-phenylethyl)-2-(thiophen-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)c(=O)n(c(n1)c1cccs1)CCc1ccccc1

STK592476
Synonyms: 5-(biphenyl-4-yl)-7-(2-fluorophenyl)-3,7-dihydrotetrazolo[1,5-a]pyrimidine
Smiles: Fc1ccccc1C1C=C(N=c2n1nn[nH]2)c1ccc(cc1)c1ccccc1

STK592477
Synonyms: N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-[3-methyl-4-(propan-2-yl)phenoxy]acetamide
Smiles: CCc1n[nH]/c(=N/C(=O)COc2ccc(c(c2)C)C(C)C)/s1

STK592478
Synonyms: N-(3-chloro-4-fluorophenyl)-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)F)nnc1COc1ccccc1

STK592482
Synonyms: 4-bromo-N'-[(E)-quinoxalin-6-ylmethylidene]benzohydrazide
Smiles: Brc1ccc(cc1)C(=O)N/N=C/c1ccc2c(c1)nccn2

STK592486
Synonyms: 2-methyl-6-phenyl-7-(pyridin-3-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Cc1ccc2c(c1)C1=C(C(O2)c2ccccc2)C(n2c(N1)ncn2)c1cccnc1

STK592487
Synonyms: 4-bromo-N-[(2E)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: CCCc1n[nH]/c(=N\C(=O)c2ccc(cc2)Br)/s1

STK592488
Synonyms: 6-methoxy-N,N-bis(2-methoxyethyl)-1H-indole-2-carboxamide
Smiles: COCCN(C(=O)c1[nH]c2c(c1)ccc(c2)OC)CCOC

STK592491
Synonyms: N'-[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]-6-methoxy-1H-indole-2-carbohydrazide
Smiles: CCOc1ccc(cc1OC)/C=N/NC(=O)c1cc2c([nH]1)cc(cc2)OC

STK592492
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK592493
Synonyms: ethyl4-[3-(2-amino-2-oxoethyl)-1-methyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyrimido[2,1-f]purin-9(6H)-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)N

STK592494
Synonyms: 6-chloro-4-{[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl}-2-oxo-2H-chromen-7-olate
Smiles: O=c1cc(C[NH+]2CCN(CC2)c2ccccc2F)c2c(o1)cc(c(c2)Cl)[O-]

STK592498
Synonyms: 8-[(4-benzylpiperidin-1-yl)methyl]-7-(2-methoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(CN2CCC(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK592499
Synonyms: 4-chloro-N-[(3Z)-1-ethyl-8-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)Cl)/c2c1nc1c(C)cccc1c2

STK592501
Synonyms: propan-2-yl{[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)OC(C)C)nnc1c1ccc(cc1)OC

STK592502
Synonyms: 4-(4-methoxyphenyl)-1-[4-(trifluoromethyl)phenyl]-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)OC2)c1ccc(cc1)C(F)(F)F

STK592503
Synonyms: N-[3-(morpholin-4-yl)propyl]-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-amine
Smiles: CC(c1nc2oc3c(c2c2c1CCC2)ncnc3NCCCN1CCOCC1)C

STK592504
Synonyms: 8-benzyl-5-(piperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine
Smiles: C1CCN(CC1)c1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1

STK592505
Synonyms: 2-[(4-chlorophenyl)sulfonyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)S(=O)(=O)c1ccc(cc1)Cl

STK592506
Synonyms: N-[6-chloro-3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-2-yl]-4-methylbenzamide
Smiles: COc1ccc(cc1OC)c1c(NC(=O)c2ccc(cc2)C)oc2c(c1=O)cc(cc2)Cl

STK592507
Synonyms: 8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(2-oxopropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1CC(=O)C)c(=O)n(c(=O)n2C)C

STK592508
Synonyms: 3-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2)/C1=O

STK592510
Synonyms: N-(2-methylpropyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: CC(CN(C(=O)c1ccccc1)Cc1cc2ccccc2[nH]c1=O)C

STK592512
Synonyms: 10,10-dimethyl-N-(2-phenylethyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: O=C(c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2)NCCc1ccccc1

STK592515
Synonyms: 7-(2-chlorophenyl)-2-(2-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1ccccc1c1nn2c(n1)c1cnn(c1nc2)c1ccccc1Cl

STK592516
Synonyms: N-(2,4-dimethoxyphenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK592517
Synonyms: 2-[(E)-(1,3-dihydro-2H-benzimidazol-2-ylidenehydrazinylidene)methyl]quinoxaline
Smiles: N(=C\c1cnc2c(n1)cccc2)/N=c/1\[nH]c2c([nH]1)cccc2

STK592518
Synonyms: (4-chlorophenyl)(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)methanone
Smiles: Clc1ccc(cc1)C(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1

STK592520
Synonyms: 5-(4-fluorophenyl)-4-{[(E)-(3-methylthiophen-2-yl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1sccc1C

STK592522
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK592523
Synonyms: N-(2,4-difluorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK592524
Synonyms: (E)-N-{[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]pyrimidin-2-yl]methoxy}-1-phenylmethanimine
Smiles: Cc1nn(c2c1C(c1cccnc1)c1c(O2)ncn2c1nc(n2)CO/N=C/c1ccccc1)c1ccccc1

STK592526
Synonyms: 3,4,5-trimethoxy-N-(2-methylpropyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)N(Cc1cc2ccccc2[nH]c1=O)CC(C)C

STK592527
Synonyms: 16-(3,4-dichlorophenyl)-3,3-dimethyl-2,3,4,6,7,11,12,16-octahydro-1H,10H-[1,4]dioxepino[2',3':6,7]isoquino[2,1-a]quinolin-1-one
Smiles: O=C1CC(C)(C)CC2=C1C(C=C1N2CCc2c1cc1c(c2)OCCCO1)c1ccc(c(c1)Cl)Cl

STK592528
Synonyms: N-[4-(4-chlorophenyl)-6-methyl-5-oxo-2-phenyl-2,5-dihydropyridazin-3-yl]-3-nitrobenzamide
Smiles: Clc1ccc(cc1)c1c(=O)c(C)nn(c1NC(=O)c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK592529
Synonyms: N-[7-(4-fluorophenyl)-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-nitrobenzamide
Smiles: Fc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)NC(=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK592530
Synonyms: 2-{4-[4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-yl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1ncnc2c1oc1c2c2CCCc2c(n1)CC(C)C

STK592531
Synonyms: (5Z)-5-{1-[(2,5-dimethoxyphenyl)amino]ethylidene}-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1N/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/C)OC

STK592534
Synonyms: methylN-[(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)carbonyl]-L-valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)N1CC(=O)Nc2c1cccc2

STK592535
Synonyms: 1-({3-[4-(diethylamino)phenyl]-4,5-dihydro-1,2-oxazol-5-yl}methyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN(c1ccc(cc1)C1=NOC(C1)Cn1c(=O)c2n(C)cnc2n(c1=O)C)CC

STK592536
Synonyms: N-(2,3-dimethoxybenzyl)-5-fluoro-N-(prop-2-en-1-yl)-1H-indole-2-carboxamide
Smiles: C=CCN(C(=O)c1cc2c([nH]1)ccc(c2)F)Cc1cccc(c1OC)OC

STK592537
Synonyms: trans-4-({[N-(tert-butoxycarbonyl)-L-methionyl]amino}methyl)cyclohexanecarboxylicacid
Smiles: CSCC[C@@H](C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)O)NC(=O)OC(C)(C)C

STK592541
Synonyms: (1'S,2'S,3R,3a'R)-1'-(2,2-dimethylpropanoyl)-2'-[(4-fluorophenyl)carbonyl]-7'-methyl-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)C)C(=O)C(C)(C)C

STK592542
Synonyms: 1-(1,3-benzodioxol-5-yl)-N-{(2S)-1-[(4-methoxybenzyl)amino]-1-oxopropan-2-yl}-5-oxopyrrolidine-3-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)[C@@H](NC(=O)C1CN(C(=O)C1)c1ccc2c(c1)OCO2)C

STK592543
Synonyms: 7-(2-ethoxyethyl)-6-hydroxy-3-methyl-8-(propylsulfanyl)-3,7-dihydro-2H-purin-2-one
Smiles: CCOCCn1c(SCCC)nc2c1c(O)nc(=O)n2C

STK592545
Synonyms: 2-(furan-2-yl)-3-(2-methoxyethyl)-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccco1

STK592546
Synonyms: N-(2-ethylphenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK592547
Synonyms: 2-[1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-1-oxo-3-phenylpropan-2-yl]-1H-isoindole-1,3(2H)-dione
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)C(N1C(=O)c2c(C1=O)cccc2)Cc1ccccc1

STK592549
Synonyms: 3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCOCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2)/C1=O

STK592550
Synonyms: 1'-hexyl-9-methyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[benzo[g]pyrido[1,2-a][1,8]naphthyridine-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCCCCCN1C(=O)NC(=O)C2(C1=O)Cc1cc3cc(C)ccc3nc1N1C2CCCC1

STK592551
Synonyms: (1'S,3R,3'S,7a'S)-1'-[(2-chlorophenyl)carbonyl]-5''-fluoro-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Fc1ccc2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccccc1Cl

STK592552
Synonyms: 2-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-(4-methoxyphenyl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCc1nnc(s1)N1C(=O)c2c(C1c1ccc(cc1)OC)c(=O)c1c(o2)ccc(c1)C

STK592553
Synonyms: N-(4-chloro-2-methylphenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)Cl)CSc1nnc(n1c1ccccc1)c1ccccn1

STK592556
Synonyms: 3-[3-(diethylamino)propyl]-6,7-dimethoxy-2-sulfanylquinazolin-4(3H)-one
Smiles: CCN(CCCn1c(S)nc2c(c1=O)cc(c(c2)OC)OC)CC

STK592559
Synonyms: 4-{[(E)-(4-chlorophenyl)methylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK592560
Synonyms: 3-[(2,6-difluorobenzyl)sulfanyl]-5-(2-fluorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(nnc1c1ccccc1F)SCc1c(F)cccc1F

STK592561
Synonyms: tert-butyl[(1S)-1-{5-[(2,5-dimethylbenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}-3-methylbutyl]carbamate
Smiles: CC(C[C@@H](c1nnc(o1)S(=O)(=O)Cc1cc(C)ccc1C)NC(=O)OC(C)(C)C)C

STK592562
Synonyms: 4-({4-chloro-N-[(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]phenylalanyl}amino)butanoicacid
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C)NC(C(=O)NCCCC(=O)O)Cc1ccc(cc1)Cl

STK592564
Synonyms: 1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-ylN-(tert-butoxycarbonyl)-D-tryptophanate
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)Cc1c[nH]c2c1cccc2

STK592565
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3-nitrophenyl)carbonyl]-2'-(pyridin-3-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccnc1)C(=O)Nc1c2cccc1)cccc3)c1cccc(c1)[N+](=O)[O-]

STK592566
Synonyms: (2S)-N-(3-acetylphenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Smiles: O=C([C@@H](n1nnc2c(c1=O)cccc2)C)Nc1cccc(c1)C(=O)C

STK592567
Synonyms: N-cycloheptyl-N~2~-{[1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]carbonyl}-L-valinamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)NC1CCCCCC1)C(C)C

STK592568
Synonyms: [4-({(2'S,3S,3'S,10b'R)-3'-[(3-methoxyphenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2'-yl}carbonyl)phenoxy]acetonitrile
Smiles: N#CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccc(c2)OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK592569
Synonyms: 2-{5-[(naphthalen-1-ylmethyl)sulfanyl]-4-phenyl-4H-1,2,4-triazol-3-yl}pyrazine
Smiles: c1ccc(cc1)n1c(SCc2cccc3c2cccc3)nnc1c1nccnc1

STK592571
Synonyms: [4-(4-methoxyphenyl)piperazin-1-yl](4,5,6,7-tetrahydro-2H-indazol-3-yl)methanone
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)c1[nH]nc2c1CCCC2

STK592572
Synonyms: 7-(2-chlorobenzyl)-10-methoxy-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-6(7H)-one
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2Cc1ccccc1Cl

STK592573
Synonyms: (3S,3'R,3a'R,6a'S)-5'-tert-butyl-3'-[(4-chlorophenyl)(hydroxy)methyl]-5-fluoro-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Clc1ccc(cc1)[C@H]([C@@H]1N[C@]2([C@@H]3[C@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cc(F)cc1)O

STK592574
Synonyms: N-{(1Z)-1-[1-cyano-2-(cyclohexylamino)-2-oxoethylidene]-1H-isoindol-3-yl}-4-fluorobenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)F)/C(=O)NC1CCCCC1

STK592575
Synonyms: 6-hydroxy-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-8-[(3-methoxypropyl)amino]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COCCCNc1nc2c(n1CC(COc1cccc(c1)C)O)c(O)nc(=O)n2C

STK592576
Synonyms: methyl4,5-dimethoxy-2-[({4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexyl}carbonyl)amino]benzoate
Smiles: COC(=O)c1cc(OC)c(cc1NC(=O)C1CCC(CC1)Cn1cnc2c(c1=O)cccc2)OC

STK592577
Synonyms: N-[(2Z)-5,5-dioxido-3-[4-(propan-2-yl)phenyl]tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenoxyacetamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccc(cc1)C(C)C)CS(=O)(=O)C2)COc1ccccc1

STK592578
Synonyms: 1',3,3'-trimethyl-8-{(E)-[2,4,6-trioxo-1-(prop-2-en-1-yl)tetrahydropyrimidin-5(2H)-ylidene]methyl}-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)-trion
Smiles: C=CCN1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=O)N(C)C(=O)N(C2=O)C)/C1=O

STK592579
Synonyms: 2-fluoro-N-(furan-2-ylmethyl)-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1ccccc1F)Cc1ccco1

STK592581
Synonyms: (4E)-2-(3-methylphenyl)-4-{[(pyridin-2-ylmethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: Cc1cccc(c1)N1C(=O)/C(=C/NCc2ccccn2)/c2c(C1=O)cccc2

STK592583
Synonyms: 2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK592587
Synonyms: N-[(1Z)-1-{1-cyano-2-[(2-methylpropyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-4-methoxybenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)OC)/C(=O)NCC(C)C

STK592590
Synonyms: (5Z)-5-[5-nitro-2-(pyrrolidin-1-yl)benzylidene]-2-thioxoimidazolidin-4-one
Smiles: O=C1NC(=S)N/C/1=C\c1cc(ccc1N1CCCC1)[N+](=O)[O-]

STK592591
Synonyms: 2-(2-{[5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinolin-8-yl]amino}ethoxy)ethanol
Smiles: OCCOCCNc1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C

STK592593
Synonyms: (1'S,3R,3'S,7a'S)-5''-chloro-1'-{[3-(prop-2-en-1-yloxy)phenyl]carbonyl}-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: C=CCOc1cccc(c1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(Cl)cc1

STK592594
Synonyms: 2-{[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)C

STK592595
Synonyms: 2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]-N-(pyridin-2-ylmethyl)acetamide
Smiles: O=C(NCc1ccccn1)COc1cc(C)cc2c1c1CCCc1c(=O)o2

STK592596
Synonyms: (5Z)-5-{[(3-benzyl-2',6'-dihydroxy-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(N/C=C/3\C(=O)NC(=O)N=C3O)ccc1N1C2CN(CC1)Cc1ccccc1

STK592599
Synonyms: ethylN-({[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)glycinate
Smiles: CCOC(=O)CNC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)OC

STK592601
Synonyms: 4-chloro-5-[(2E)-2-(3-phenoxybenzylidene)hydrazinyl]pyridazin-3-ol
Smiles: Oc1nncc(c1Cl)N/N=C/c1cccc(c1)Oc1ccccc1

STK592602
Synonyms: 2-{[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)C

STK592603
Synonyms: N-(2-methoxydibenzo[b,d]furan-3-yl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc2c(cc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1)oc1c2cccc1

STK592606
Synonyms: 4-(2-fluorophenyl)-4,10-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: NC1=NC(n2c(=N1)[nH]c1c2cccc1)c1ccccc1F

STK592609
Synonyms: 3-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-5-[(naphthalen-1-ylmethyl)sulfanyl]-4H-1,2,4-triazol-4-amine
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCc1cccc2c1cccc2

STK592611
Synonyms: N-[(3Z)-6-methoxy-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-methylbenzamide
Smiles: COc1ccc2c(c1)cc1c(n2)n([nH]/c/1=N\C(=O)c1ccc(cc1)C)CC(C)C

STK592613
Synonyms: 2-{[4-(4-methoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(nnc1SCC(=O)N)COc1ccccc1

STK592614
Synonyms: N-(3-chloro-4-fluorophenyl)-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CCn1nnc2c(c1=O)cccc2

STK592615
Synonyms: methyl4-{[(3Z)-1-ethyl-6-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]amino}-4-oxobutanoate
Smiles: COC(=O)CCC(=O)/N=c/1\[nH]n(c2c1cc1cc(C)ccc1n2)CC

STK592617
Synonyms: 4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-5-(4-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)N(C)C

STK592619
Synonyms: 1-hydroxy-9-oxo-9H-xanthen-3-ylN-[(4-methylphenyl)sulfonyl]norvalinate
Smiles: CCCC(C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1)NS(=O)(=O)c1ccc(cc1)C

STK592622
Synonyms: (5E)-1-(3-methylphenyl)-5-[(morpholin-4-ylamino)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cccc(c1)N1C(=NC(=O)/C(=C\NN2CCOCC2)/C1=O)S

STK592623
Synonyms: 1'-(2-chlorobenzyl)-2'-hydroxy-9-methyl-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[benzo[g]pyrido[1,2-a][1,8]naphthyridine-5,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: Cc1ccc2c(c1)cc1c(n2)N2CCCCC2C2(C1)C(=O)N=C(N(C2=O)Cc1ccccc1Cl)O

STK592628
Synonyms: (1'R,2'R)-2'-(2-ethoxyphenyl)-7'-methyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: CCOc1ccccc1[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C

STK592629
Synonyms: 10,10-dimethyl-2-[(4-methylpiperazin-1-yl)methyl]-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CN1CCN(CC1)Cc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK592631
Synonyms: 1-benzyl-2-(4-methoxyphenyl)-5,6-diphenyl-1H-imidazo[1,2-a]imidazole
Smiles: COc1ccc(cc1)c1cn2c(n1Cc1ccccc1)nc(c2c1ccccc1)c1ccccc1

STK592632
Synonyms: 2-(5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)-N-(2-phenylethyl)acetamide
Smiles: O=C(Cn1c2ccccc2c2c1c(=O)n1CCSc1n2)NCCc1ccccc1

STK592633
Synonyms: 10-(4-methoxyphenyl)-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: COc1ccc(cc1)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccc(cc1)C)C

STK592634
Synonyms: 2-(2-{[2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl]amino}ethoxy)ethanol
Smiles: OCCOCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C(C)C

STK592635
Synonyms: 8-[(4-benzylpiperazin-1-yl)methyl]-7-hexyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(CN2CCN(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK592637
Synonyms: 2-[7-(4-fluorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]phenol
Smiles: Fc1ccc(cc1)n1ncc2c1ncn1c2nnc1c1ccccc1O

STK592638
Synonyms: 2-(methylsulfanyl)-9-(2,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nc2n(n1)C(C1=C(O)CCCC1=N2)c1cc(OC)c(cc1OC)OC

STK592640
Synonyms: 3-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-1-(2,3-dimethylphenyl)pyrrolidine-2,5-dione
Smiles: COc1cc2c(cc1OC)CCN(C2C)C1CC(=O)N(C1=O)c1cccc(c1C)C

STK592641
Synonyms: (1'S,3R,3'S,7a'S)-5''-chloro-1'-[(3-propoxyphenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCCOc1cccc(c1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(Cl)cc1

STK592642
Synonyms: 3-(3-chlorophenyl)-1-[2-(dimethylamino)ethyl]-1,5,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: CN(CCn1c2sc3c(c2c(=O)n(c1=O)c1cccc(c1)Cl)CCCCC3)C

STK592643
Synonyms: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C(F)(F)F)Cl)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK592646
Synonyms: 1-(3-methoxyphenyl)-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK592647
Synonyms: N-[5,7-bis(4-chlorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzenesulfonamide
Smiles: Clc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)NS(=O)(=O)c1ccccc1)c1ccc(cc1)Cl

STK592648
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-dimethylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)C)C)nnc1COc1ccc(cc1)Cl

STK592649
Synonyms: 4-[(E)-(4-iminio-2-oxo-2H-pyrimido[2,1-b][1,3]benzothiazol-3(4H)-ylidene)methyl]phenolate
Smiles: [O-]c1ccc(cc1)/C=C\1/C(=O)N=c2n(C1=[NH2+])c1ccccc1s2

STK592650
Synonyms: (6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)[4-(trifluoromethoxy)phenyl]methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc(cc1)OC(F)(F)F

STK592651
Synonyms: 2-{[4-(4-chlorophenyl)-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dimethylphenyl)acetamide
Smiles: COc1ccccc1c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(c(c1)C)C

STK592652
Synonyms: methyl2-[({4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexyl}carbonyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)C1CCC(CC1)Cn1cnc2c(c1=O)cccc2

STK592656
Synonyms: 1-(2,3-dimethoxyphenyl)-2-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1c(OC)cccc1C1N(C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK592657
Synonyms: N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-2-[(2,2-dimethylpropanoyl)amino]benzamide
Smiles: O=C(c1ccccc1NC(=O)C(C)(C)C)/N=c/1\sc2c([nH]1)cccc2

STK592660
Synonyms: 2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-(3-hydroxypropyl)acetamide
Smiles: Cc1c(OCC(=O)NCCCO)ccc2c1oc(=O)cc2C

STK592662
Synonyms: N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-6-methoxy-1H-indole-2-carbohydrazide
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)N/N=C/c1cccc(c1OC)OC

STK592664
Synonyms: 4-chloro-N-[3-(4-methoxyphenyl)-4-oxo-4H-thiochromen-2-yl]benzamide
Smiles: COc1ccc(cc1)c1c(NC(=O)c2ccc(cc2)Cl)sc2c(c1=O)cccc2

STK592665
Synonyms: 5,7-dichloro-1-(3-ethoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c(Cl)cc(c1)Cl

STK592666
Synonyms: N-[(2Z)-3-(2-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]tetrahydrofuran-2-carboxamide
Smiles: O=C(C1CCCO1)/N=C/1\SC2C(N1c1ccccc1F)CS(=O)(=O)C2

STK592667
Synonyms: 2-(4-chlorophenyl)-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-ol
Smiles: Clc1ccc(cc1)c1nc2n(n1)c(O)c1c(n2)CCC1

STK592669
Synonyms: (3S,3a'S,8a'S,8b'R)-5-fluoro-2'-(tetrahydrofuran-2-ylmethyl)-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: Fc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)CC1CCCO1

STK592670
Synonyms: N-(4-chlorophenyl)-6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)hexanamide
Smiles: O=C(Nc1ccc(cc1)Cl)CCCCCn1nnc2c(c1=O)cccc2

STK592673
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-chlorophenyl)methylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N

STK592674
Synonyms: 3-(2,4-dichlorobenzyl)-1,7,8-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(c(c1)Cl)Cn1c(=O)c2n3cc(n(c3nc2n(c1=O)C)C)C

STK592675
Synonyms: 8-{[(2-chlorobenzyl)amino]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccccc1CNCc1[nH]c2c(n1)n(C)c(=O)n(c2=O)C

STK592677
Synonyms: 7,7-dimethyl-2-(4-methylphenyl)-4-[(2-methylprop-2-en-1-yl)sulfanyl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: CC(=C)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C

STK592679
Synonyms: 2-(3,4-dimethoxyphenyl)-11-(2-methoxyphenyl)-10-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)c1ccc(c(c1)OC)OC)c1ccccc1

STK592680
Synonyms: 5-methoxy-N'-{(E)-[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1H-indole-2-carbohydrazide
Smiles: C=CCOc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)ccc(c2)OC

STK592681
Synonyms: 6-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-5-(4-methyl-3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: COc1cc(ccc1OC)CCn1cc2c(c1c1ccc(c(c1)[N+](=O)[O-])C)c(=O)n(c(=O)n2C)C

STK592682
Synonyms: (8E)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-[(2E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinylidene]-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: OC(Cn1/c(=N/N=C\2/C(=O)Nc3c2cccc3)/[nH]c2c1c(=O)n(C)c(=O)n2C)COc1ccccc1

STK592683
Synonyms: 1-(4-methoxyphenyl)-N,4-bis(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)C)n2c3c1CCCCn3c(c2)c1ccc(cc1)C

STK592685
Synonyms: (5E)-3-(4-chlorophenyl)-5-{1-[(3,5-dimethoxybenzyl)amino]propylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/NCc1cc(OC)cc(c1)OC

STK592686
Synonyms: 2-(6-methoxy-1,3-benzothiazol-2-yl)-1-[4-(propan-2-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)OC(C)C)c(=O)c1c(o2)cccc1

STK592687
Synonyms: N-[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-methylbutanamide
Smiles: CC(CC(=O)/N=C/1\SC2C(N1Cc1ccc3c(c1)OCO3)CS(=O)(=O)C2)C

STK592688
Synonyms: 10-(2-hydroxyphenyl)-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: Oc1ccccc1C1OCCn2c1c1c(c2c2ccccc2)c(=O)n(c(=O)n1C)C

STK592689
Synonyms: 4-{(Z)-[2-(3-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-chloro-6-methoxyphenylacetate
Smiles: COc1cc(/C=C/2\N=C(OC2=O)c2cccc(c2)Br)cc(c1OC(=O)C)Cl

STK592690
Synonyms: N-[2-(diethylamino)ethyl]-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CCN(CCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2)CC

STK592691
Synonyms: 2-(2-fluorophenyl)-4-imino-6,7,11,12-tetrahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc2OCCCOc2c1)c1ccccc1F

STK592692
Synonyms: (4E)-5-(2-fluorophenyl)-4-[hydroxy(4-nitrophenyl)methylidene]-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: O/C(=C/1\C(c2ccccc2F)N(C(=O)C1=O)c1cccc(c1)C(F)(F)F)/c1ccc(cc1)[N+](=O)[O-]

STK592693
Synonyms: 2',6'-dihydroxy-8-nitro-3-propanoyl-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-4'-one
Smiles: CCC(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=NC(=NC1=O)O)O

STK592696
Synonyms: 2-(2-amino-6-methyl-5-phenylpyrimidin-4-yl)-5-[(3-chlorobenzyl)oxy]phenol
Smiles: Nc1nc(C)c(c(n1)c1ccc(cc1O)OCc1cccc(c1)Cl)c1ccccc1

STK592698
Synonyms: N-(3-chloro-4-fluorophenyl)-2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK592700
Synonyms: 5-(2-methoxyphenyl)-4-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2c2ccccc2OC)cc(c1OC)OC

STK592701
Synonyms: (2E)-3-(1,3-benzodioxol-5-yl)-N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}prop-2-enamide
Smiles: O=C(/C=C/c1ccc2c(c1)OCO2)NCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK592702
Synonyms: 3-(furan-2-ylmethyl)-4-imino-6,6-dimethyl-1-(2-oxo-2-phenylethyl)-1,3,4,5,6,8-hexahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-one
Smiles: O=C(c1ccccc1)Cn1c(=O)n(Cc2ccco2)c(=N)c2c1sc1c2CC(OC1)(C)C

STK592706
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-methyl-6-(propan-2-yl)phenyl]acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1c(C)cccc1C(C)C

STK592707
Synonyms: 2-[(3a'S,6a'R)-7-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]acetamide
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cccc2Cl

STK592709
Synonyms: 4-hydroxy-1,6,7-trimethyl-8-(1-phenylethyl)-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: CC(n1c(C)c(n2c1nc1c2c(O)nc(=O)n1C)C)c1ccccc1

STK592710
Synonyms: N-{2-[2-(4-ethylpiperazin-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-4-methoxybenzamide
Smiles: CCN1CCN(CC1)CCc1nc2c(n1C)ccc(c2)NC(=O)c1ccc(cc1)OC

STK592711
Synonyms: 2-{(2E)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-3-hydroxyquinazolin-4(3H)-one
Smiles: C/C(=N\Nc1nc2ccccc2c(=O)n1O)/c1ccco1

STK592712
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/[O-])/C(N1CCCn1c[nH+]cc1)c1ccc(cc1)[N+](=O)[O-]

STK592714
Synonyms: 4-imino-2-[3-methoxy-4-(2-methylpropoxy)phenyl]-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: COc1cc(ccc1OCC(C)C)c1cc2c3cc4OCOc4cc3CCn2c(=N)c1C#N

STK592716
Synonyms: N'-{(E)-[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}benzohydrazide
Smiles: Fc1ccc(cc1)N1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2)/C1=O)S

STK592717
Synonyms: (4E)-5-(4-butoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC

STK592718
Synonyms: N-[2-(2-hydroxyethoxy)ethyl]-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: OCCOCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2

STK592719
Synonyms: 3-benzyl-2-[(3-hydroxypropyl)amino]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: OCCCNc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCCCC3

STK592720
Synonyms: (5E)-5-(1-{[4-(diethylamino)phenyl]amino}propylidene)-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\Nc2ccc(cc2)N(CC)CC)/CC)/C1=O)O

STK592722
Synonyms: [(2E)-4-hydroxy-2-{(2E)-[(5-iodofuran-2-yl)methylidene]hydrazinylidene}-2,5-dihydro-1,3-thiazol-5-yl]aceticacid
Smiles: OC1=N/C(=N\N=C\c2ccc(o2)I)/SC1CC(=O)O

STK592723
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-chlorophenyl)carbonyl]-2'-(pyridin-3-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)c1cccnc1)C(=O)Nc1c2cccc1)cccc3

STK592724
Synonyms: 5-amino-9-oxo-8-(pyridin-3-yl)-11-(thiophen-2-yl)-9,10,11,12-tetrahydro-8H-quino[1,2-a]quinazoline-7-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cccnc1)C(=O)CC(C2)c1cccs1)cccc3

STK592725
Synonyms: 3-[(4-chlorophenoxy)methyl]-5-[(2,6-dichlorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazole
Smiles: Clc1ccc(cc1)OCc1nnc(n1Cc1ccco1)SCc1c(Cl)cccc1Cl

STK592726
Synonyms: 2-[11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]naphthalen-1-ol
Smiles: Cc1nn(c2c1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1ccc2c(c1O)cccc2)c1ccccc1

STK592727
Synonyms: (6E)-4-(1-benzofuran-2-yl)-6-[(4-phenoxyphenyl)imino]-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: Nc1[nH]/c(=N\c2ccc(cc2)Oc2ccccc2)/nc(n1)c1cc2c(o1)cccc2

STK592730
Synonyms: N-[4-(butan-2-yl)phenyl]-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1)C

STK592731
Synonyms: (2Z)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-1-[4-(trifluoromethoxy)phenyl]ethanone
Smiles: O=C(c1ccc(cc1)OC(F)(F)F)/C=C/1\NCCc2c1cc1OCOc1c2

STK592733
Synonyms: N-[(4E)-2-(thiophen-2-yl)-4H-chromen-4-ylidene]benzene-1,2-diamine
Smiles: Nc1ccccc1/N=c/1\cc(oc2c1cccc2)c1cccs1

STK592734
Synonyms: 1-{[1-(tert-butoxycarbonyl)piperidin-4-yl]carbonyl}-L-proline
Smiles: OC(=O)[C@@H]1CCCN1C(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK592735
Synonyms: 4-(2-chloro-5-nitrophenyl)-2-[(2,4-dimethylphenyl)amino]-8-methyl-4,9-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Smiles: Cc1ccc(c(c1)C)NC1=NC(n2c(=N1)[nH]c(C)cc2=O)c1cc(ccc1Cl)[N+](=O)[O-]

STK592736
Synonyms: 5-{[(2Z)-3-(2,3-dimethylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)/N=C/1\SC2C(N1c1cccc(c1C)C)CS(=O)(=O)C2

STK592739
Synonyms: (5Z)-5-(3,4-diethoxybenzylidene)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCOc1cc(ccc1OCC)/C=C/1\C(=O)N(C2CCS(=O)(=O)C2)C(=O)C(=C1C)C#N

STK592740
Synonyms: 3-(5,11-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenol
Smiles: Oc1cccc(c1)c1nn2c(n1)c1c(nc2C)sc2c1C(C)CCC2

STK592741
Synonyms: 4-hydroxy-8-[3-(1H-imidazol-1-yl)propyl]-1,6,7-trimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Oc1nc(=O)n(c2c1n1c(n2)n(c(c1C)C)CCCn1cncc1)C

STK592742
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[methyl(phenyl)amino]methyl}-N'-[(E)-naphthalen-2-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CN(c1ccccc1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc2c(c1)cccc2

STK592743
Synonyms: (5Z)-5-(1-{[3-(dimethylamino)propyl]amino}ethylidene)-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CN(CCCN/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/C)C

STK592744
Synonyms: [4-(3-methoxyphenyl)piperazin-1-yl](4,5,6-trimethoxy-1H-indol-2-yl)methanone
Smiles: COc1cccc(c1)N1CCN(CC1)C(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC

STK592745
Synonyms: (1'S,3R,3'S,7a'S)-5''-chloro-1'-[(2-ethoxyphenyl)carbonyl]-7''-methyl-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCOc1ccccc1C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(Cl)cc1C

STK592746
Synonyms: N-[(2Z)-3-(2,4-dimethoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenylacetamide
Smiles: COc1ccc(c(c1)OC)N1/C(=N/C(=O)Cc2ccccc2)/SC2C1CS(=O)(=O)C2

STK592747
Synonyms: 1-(2-methoxyphenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: COc1ccccc1C(=O)CSc1nnc(n1c1ccccc1)c1cnccn1

STK592749
Synonyms: 3-[2-ammonio-3-(methoxycarbonyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl]benzoate
Smiles: COC(=O)c1c([NH3+])n(c2c1nc1ccccc1n2)c1cccc(c1)C(=O)[O-]

STK592750
Synonyms: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-N-(2-methoxybenzyl)-N-methylacetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)N(Cc1ccccc1OC)C

STK592751
Synonyms: ([(3-fluorophenyl)amino]{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}methylidene)propanedinitrile
Smiles: N#CC(=C(Nc1cccc(c1)F)SCC(=O)c1ccc(cc1)OC)C#N

STK592752
Synonyms: (1'S,3R,3'S,7a'S)-7''-chloro-5''-methyl-1'-(thiophen-2-ylcarbonyl)-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: Cc1cc(Cl)c2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccs1

STK592753
Synonyms: 3-[(5Z)-4-oxo-5-{[5-(piperidinium-1-yl)furan-2-yl]methylidene}-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Smiles: [O-]C(=O)CCN1C(=S)S/C(=C\c2ccc(o2)[NH+]2CCCCC2)/C1=O

STK592754
Synonyms: 3-butyl-6-ethyl-10-methyl-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: CCCCN1COc2c(C1)cc1c(c2C)oc(=O)cc1CC

STK592757
Synonyms: 5,9-dimethyl-2-[4-(propan-2-yloxy)phenyl]-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)c1ccc(cc1)OC(C)C

STK592758
Synonyms: 1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(CN2CCC(CC2)C)nc2c1c(=O)n(c(=O)n2C)C

STK592759
Synonyms: (3S)-N-{(2S)-1-[(3,5-dimethylphenyl)amino]-1-oxopropan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C)Nc1cc(C)cc(c1)C

STK592760
Synonyms: (4E)-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(4-nitrophenyl)methylidene]-1-(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1ccc(c(c1)OC)O

STK592761
Synonyms: N-(4-chlorobenzyl)-2-(5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)acetamide
Smiles: O=C(Cn1c2ccccc2c2c1c(=O)n1CCSc1n2)NCc1ccc(cc1)Cl

STK592762
Synonyms: 6,8-dibromo-2,4-dihydroxy-N-pentylquinoline-3-carboxamide
Smiles: CCCCCNC(=O)c1c(O)nc2c(c1O)cc(cc2Br)Br

STK592763
Synonyms: 2-[(6-chloro-4-phenylquinazolin-2-yl)amino]quinazolin-4-ol
Smiles: Clc1ccc2c(c1)c(nc(n2)Nc1nc(O)c2c(n1)cccc2)c1ccccc1

STK592764
Synonyms: 2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-(propan-2-yl)phenyl]acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)C)nnc1COc1ccc(cc1)C

STK592766
Synonyms: 9-(4-fluorophenyl)-1-methyl-3-(3-phenylpropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCCc1ccccc1

STK592768
Synonyms: 2-[(4,4-dimethyl-1,3-oxazolidin-3-yl)carbonyl]-1-(3-methoxypropyl)pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)N1COCC1(C)C

STK592769
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(diethylamino)phenyl]methylidene}-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N)CC

STK592773
Synonyms: 3-[(9-fluoro-5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)methyl]benzonitrile
Smiles: N#Cc1cccc(c1)Cn1c2ccc(cc2c2c1c(=O)n1CCSc1n2)F

STK592774
Synonyms: 3-(4-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)cc2O

STK592775
Synonyms: (4Z)-6-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-4-[(2,4-dimethylphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Cc1ccc(c(c1)C)/N=c\1/[nH]c(CN2CCN(CC2)c2cccc(c2)Cl)nc(n1)N

STK592776
Synonyms: N-[4-(3-methoxyphenyl)-6-methyl-2-(4-methylphenyl)-5-oxo-2,5-dihydropyridazin-3-yl]-2-methylbenzamide
Smiles: COc1cccc(c1)c1c(=O)c(C)nn(c1NC(=O)c1ccccc1C)c1ccc(cc1)C

STK592777
Synonyms: N-[(2Z)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-ylidene]-2-{[5-(2-methylfuran-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamide
Smiles: Clc1ccc(cc1)c1cs/c(=N\C(=O)CSc2nnc(o2)c2ccoc2C)/[nH]1

STK592778
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dimethoxyphenyl)methylidene]-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1OC)OC

STK592781
Synonyms: (5E)-5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-1-[4-(propan-2-yl)phenyl]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CC(c1ccc(cc1)N1C(=NC(=O)/C(=C\Nc2c(=O)n(n(c2C)C)c2ccccc2)/C1=O)S)C

STK592782
Synonyms: N-(2-chlorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1ccccc1Cl

STK592784
Synonyms: N-(4-butylphenyl)-2-{[5-(2-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1CC)c1ccccc1Cl

STK592785
Synonyms: (1Z)-3-(4-tert-butylphenoxy)-1-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)butan-2-one
Smiles: O=C(C(Oc1ccc(cc1)C(C)(C)C)C)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK592786
Synonyms: 3-(2,2-dimethoxyethyl)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4(3H)-one
Smiles: COC(Cn1cnc2c(c1=O)oc1c2cc2c(n1)CC(OC2)(C)C)OC

STK592787
Synonyms: 1-[(2,6-dichlorobenzyl)sulfanyl]-4-phenyl-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Clc1cccc(c1CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCC3)Cl

STK592789
Synonyms: methyl5-acetyl-2-({(Z)-2-cyano-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methylthiophene-3-carboxylate
Smiles: N#C/C(=C/Nc1sc(c(c1C(=O)OC)C)C(=O)C)/c1scc(n1)c1ccc(cc1)F

STK592790
Synonyms: 2-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1H-isoindol-1-imine
Smiles: N=C1N(Cc2c1cccc2)C1CC(C)(C)NC(C1)(C)C

STK592791
Synonyms: N-[3,5-bis(trifluoromethyl)phenyl]-2-{[4-ethyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)nnc1Cc1cccs1

STK592793
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-ethoxy-4-(pentyloxy)phenyl]-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccc(cc1)F

STK592795
Synonyms: N-(4-ethoxyphenyl)-2-{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)OC

STK592796
Synonyms: 6,6-dimethyl-2-(methylsulfanyl)-9-(thiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nn2c(n1)N=C1C(=C(O)CC(C1)(C)C)C2c1cccs1

STK592797
Synonyms: ethyl4-[(10-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)sulfanyl]butanoate
Smiles: CCOC(=O)CCCSc1nc2sc3c(c2c2n1ncn2)CC(CC3)C

STK592798
Synonyms: ethyl2-[(3E)-3-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(c2cccnc2)/C(=C(/c2ccc(cc2)OC(C)C)\O)/C(=O)C1=O

STK592801
Synonyms: (4E)-2-(2,5-dimethoxyphenyl)-4-{[(1,1-dioxidotetrahydrothiophen-3-yl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccc(c(c1)N1C(=O)/C(=C/NC2CCS(=O)(=O)C2)/c2c(C1=O)cccc2)OC

STK592802
Synonyms: 8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-7-(3-hydroxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCCn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK592803
Synonyms: 8-[(6-chloropyridin-3-yl)sulfonyl]-7-methyl-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: Clc1ccc(cn1)S(=O)(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1

STK592804
Synonyms: N-[(1-ethylpyrrolidin-2-yl)methyl]-5-methoxy-3-methyl-1H-indole-2-carboxamide
Smiles: CCN1CCCC1CNC(=O)c1[nH]c2c(c1C)cc(cc2)OC

STK592805
Synonyms: N,N-diethyl-N'-[4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-yl]ethane-1,2-diamine
Smiles: CCN(CCNc1ncnc2c1oc1c2c2CCCc2c(n1)CC(C)C)CC

STK592806
Synonyms: 3-(3-ethoxypropyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCOCCCn1cnc2c(c1=O)[nH]c1c2cccc1

STK592807
Synonyms: 2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(pyridin-4-ylmethyl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)NCc1ccncc1

STK592808
Synonyms: N-(4-butylphenyl)-2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccccc1Cl

STK592809
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1,5-bis(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1ccc(cc1)OC

STK592810
Synonyms: N-(2-methoxyphenyl)-2,2-dimethyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]propanamide
Smiles: COc1ccccc1N(C(=O)C(C)(C)C)Cc1cc2cccc(c2[nH]c1=O)C

STK592812
Synonyms: (4E)-4-{[(1,1-dioxidotetrahydrothiophen-3-yl)amino]methylidene}-2-(4-fluorophenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)/C(=C/NC2CCS(=O)(=O)C2)/c2c(C1=O)cccc2

STK592813
Synonyms: 3-cyclopentyl-10-methyl-2-(thiophen-2-yl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: Cn1c2nc(c3cccs3)n(c(=O)c2c(=O)c2c1cccc2)C1CCCC1

STK592814
Synonyms: (4E)-2-(2,5-dimethoxyphenyl)-4-({[(1-ethylpyrrolidin-2-yl)methyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1cc(OC)ccc1OC

STK592815
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1/N=C/c1ccc(cc1)c1ccccc1)c1ccccc1

STK592816
Synonyms: 6-(butan-2-yl)-2-hydroxy-1-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCC(N1CNc2c(C1)c(=O)nc(n2c1ccc(cc1)OC)O)C

STK592817
Synonyms: 5-{1-[(3,5-dimethoxybenzyl)amino]propylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCC(=C1C(=O)N(C)C(=O)N(C1=O)C)NCc1cc(OC)cc(c1)OC

STK592818
Synonyms: 4-{[(2'S,3S,3'S,10b'R)-2-oxo-2'-{[4-(propan-2-yloxy)phenyl]carbonyl}-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl]carbonyl}phenylacetate
Smiles: CC(Oc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC(=O)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C

STK592819
Synonyms: 4-{(2E)-2-[(5-methoxy-1H-indol-3-yl)methylidene]hydrazinyl}-5-phenylthieno[2,3-d]pyrimidine
Smiles: COc1ccc2c(c1)c(/C=N/Nc1ncnc3c1c(cs3)c1ccccc1)c[nH]2

STK592820
Synonyms: 4-{[(2Z)-3-(3-chloro-4-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)/N=C/1\SC2C(N1c1ccc(c(c1)Cl)F)CS(=O)(=O)C2

STK592821
Synonyms: N-[(2E)-1,3-benzoxazol-2(3H)-ylidene]-5-(2-methoxyethyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: COCCN1CNC(=NC1)/N=c\1/oc2c([nH]1)cccc2

STK592822
Synonyms: ethyl2-amino-1-(3,5-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(OC)cc(c1)OC

STK592823
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3-methoxyphenyl)carbonyl]-2'-{[4-(prop-2-en-1-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: C=CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccc(c2)OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK592824
Synonyms: N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanamide
Smiles: CCC(=O)Nc1nn2c(=NC(=CC2c2ccc(cc2)F)c2ccc(cc2)Cl)[nH]1

STK592825
Synonyms: 5-(2,4-dichlorophenyl)-4-{[(E)-(3,4-dihydroxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(c(c1)Cl)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)O)O

STK592826
Synonyms: 6,7-dimethoxy-2-(thiophen-2-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)S(=O)(=O)c1cccs1

STK592827
Synonyms: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK592828
Synonyms: N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-2-(3,4-dimethylphenoxy)acetamide
Smiles: O=C(COc1ccc(c(c1)C)C)NCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK592830
Synonyms: (6,7-dimethoxy-1-phenyl-3,4-dihydroisoquinolin-2(1H)-yl)(2-fluorophenyl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2c1ccccc1)C(=O)c1ccccc1F

STK592831
Synonyms: 6-benzyl-2-hydroxy-1-(4-methylphenyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)Cc1ccccc1

STK592832
Synonyms: {(3E)-2-(4-chlorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}aceticacid
Smiles: OC(=O)CN1C(c2ccc(cc2)Cl)/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C1=O

STK592833
Synonyms: N-(3-fluoro-4-methylphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1c1ccccn1

STK592835
Synonyms: 7-(3-chlorobenzyl)-1,3-dimethyl-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cccc(c1)Cn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK592836
Synonyms: (4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OCC)/O)/C1c1ccc(c(c1)OC)O

STK592839
Synonyms: 3-{[4-(morpholin-4-ylcarbonyl)cyclohexyl]methyl}-1,2,3-benzotriazin-4(3H)-one
Smiles: O=C(N1CCOCC1)C1CCC(CC1)Cn1nnc2c(c1=O)cccc2

STK592840
Synonyms: 2-[(2E)-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}hydrazinylidene]-2,3-dihydro-1H-benzimidazole
Smiles: Clc1ccc(c(c1)c1ccc(o1)/C=N/N=c/1\[nH]c2c([nH]1)cccc2)Cl

STK592841
Synonyms: N-{(1Z)-1-[1-cyano-2-oxo-2-(propylamino)ethylidene]-1H-isoindol-3-yl}furan-2-carboxamide
Smiles: CCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccco1)/C#N

STK592843
Synonyms: 3-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)carbonyl]-N,N-dimethylbenzenesulfonamide
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)c1cccc(c1)S(=O)(=O)N(C)C

STK592844
Synonyms: methylN-[3-(1H-benzimidazol-1-yl)propanoyl]glycinate
Smiles: COC(=O)CNC(=O)CCn1cnc2c1cccc2

STK592845
Synonyms: N-(3,4-dimethoxybenzyl)-4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]benzamide
Smiles: COc1ccc(cc1OC)CNC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK592846
Synonyms: N-(5-chloro-2-methylphenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1c1ccccc1)c1ccccn1

STK592847
Synonyms: N-(4-iodophenyl)-2,6,8-trimethylquinolin-4-amine
Smiles: Ic1ccc(cc1)Nc1cc(C)nc2c1cc(C)cc2C

STK592849
Synonyms: 3-cyclopentyl-10-methyl-6-propyl-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: CCCc1cc(=O)oc2c1cc1CN(COc1c2C)C1CCCC1

STK592851
Synonyms: 1-(3-methoxyphenyl)-2-(prop-2-en-1-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: C=CCN1C(=O)c2c(C1c1cccc(c1)OC)c(=O)c1c(o2)cccc1

STK592852
Synonyms: N-[(2Z)-3-(5-chloro-2,4-dimethoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2,2-dimethylpropanamide
Smiles: COc1cc(OC)c(cc1N1/C(=N/C(=O)C(C)(C)C)/SC2C1CS(=O)(=O)C2)Cl

STK592853
Synonyms: {[(3-bromobenzyl)sulfanyl][(3-fluorophenyl)amino]methylidene}propanedinitrile
Smiles: N#CC(=C(Nc1cccc(c1)F)SCc1cccc(c1)Br)C#N

STK592855
Synonyms: 2-[(3-methylbenzyl)sulfanyl]-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1cc(cc(c1OC)OC)C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1cccc(c1)C

STK592857
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,3-dimethylphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1cccc(c1C)C

STK592859
Synonyms: 6,7-dimethoxy-1-methyl-2-{[2-(trifluoromethyl)phenyl]sulfonyl}-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2c(cc1OC)CCN(C2C)S(=O)(=O)c1ccccc1C(F)(F)F

STK592863
Synonyms: N-(6-fluoro-1,3-benzothiazol-2-yl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide
Smiles: Cc1cc(C)c(c(c1)c1[nH]nc(c1)C(=O)Nc1sc2c(n1)ccc(c2)F)O

STK592864
Synonyms: 8-{[bis(2-methylpropyl)ammonio]methyl}-3-(naphthalen-2-yloxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: CC(C[NH+](Cc1c([O-])ccc2c1oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F)CC(C)C)C

STK592865
Synonyms: 1-[4-(2-fluorophenyl)piperazin-1-yl]-3-(2-methyl-1H-benzimidazol-1-yl)propan-1-one
Smiles: O=C(N1CCN(CC1)c1ccccc1F)CCn1c(C)nc2c1cccc2

STK592866
Synonyms: 6-[(E)-(2-benzylhydrazinylidene)methyl]quinoxaline
Smiles: c1ccc(cc1)CN/N=C/c1ccc2c(c1)nccn2

STK592867
Synonyms: methylN-[(4-fluorophenyl)carbamoyl]-D-leucinate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc(cc1)F)CC(C)C

STK592869
Synonyms: N-(3,4-dimethylphenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1

STK592870
Synonyms: ethyl[(2Z)-2-{[(2E)-3-phenylprop-2-enoyl]imino}-2,3-dihydro-1,3-thiazol-4-yl]acetate
Smiles: CCOC(=O)Cc1cs/c(=N\C(=O)/C=C/c2ccccc2)/[nH]1

STK592871
Synonyms: N-[(2Z)-3-(4-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenoxyacetamide
Smiles: COc1ccc(cc1)CN1/C(=N/C(=O)COc2ccccc2)/SC2C1CS(=O)(=O)C2

STK592873
Synonyms: 5-{4-[(4-chlorobenzyl)oxy]phenyl}-N'-[(E)-(4-fluorophenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: Fc1ccc(cc1)/C=N/NC(=O)c1n[nH]c(c1)c1ccc(cc1)OCc1ccc(cc1)Cl

STK592874
Synonyms: 2-[(4Z)-4-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-3-oxobutan-2-yl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(C(N1C(=O)c2c(C1=O)cccc2)C)/C=C/1\NCCc2c1cc1OCOc1c2

STK592875
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-6-methyl-3-(4-nitrophenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: O=C1N(C)C(=O)[C@@H]2[C@H]1[C@H]1C[C@@H]2[C@@H]2[C@H]1C(=NO2)c1ccc(cc1)[N+](=O)[O-]

STK592876
Synonyms: 2-chloro-8-methyl-3-{(E)-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazinylidene]methyl}quinoline
Smiles: Clc1nc2c(cc1/C=N/Nc1ncnc3c1c(cs3)c1ccccc1)cccc2C

STK592877
Synonyms: 4-{[(E)-(2,3-dichlorophenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1c(cccc1Cl)/C=N/n1c(=S)[nH]nc1c1ccccn1

STK592879
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK592881
Synonyms: N-(4-butylphenyl)-2-{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C2=C(CC(CC2=N1)(C)C)O)c1ccc(cc1)Cl

STK592882
Synonyms: N-(3-chlorophenyl)-2-{[4-(4-methoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Cl)nnc1COc1ccccc1

STK592884
Synonyms: (4E)-5-(4-bromophenyl)-4-[hydroxy(phenyl)methylidene]-1-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: Brc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(cc1)C

STK592885
Synonyms: 1-(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)-3-propan-2-ylthiourea
Smiles: CC(NC(=S)Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)C

STK592886
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nnc1c1cccc(c1)Cl

STK592888
Synonyms: (5E)-6-hydroxy-3-(2-methylphenyl)-5-{1-[(tetrahydrofuran-2-ylmethyl)amino]ethylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C(\NCC2CCCO2)/C)/C(=O)N1c1ccccc1C

STK592889
Synonyms: (5-bromo-3-methyl-1H-indol-2-yl)[4-(2-fluorophenyl)piperazin-1-yl]methanone
Smiles: Brc1ccc2c(c1)c(C)c([nH]2)C(=O)N1CCN(CC1)c1ccccc1F

STK592890
Synonyms: 8-(3,4-dimethylphenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Cc1ccc(cc1C)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK592891
Synonyms: N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]-2-propoxybenzamide
Smiles: CCCOc1ccccc1C(=O)Nc1nonc1c1ccc(cc1)Cl

STK592892
Synonyms: 3-[(3-methylbenzyl)sulfanyl]-5-[(4-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)OCc1nnc(n1c1ccccc1)SCc1cccc(c1)C

STK592894
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazole-4-carboxylicacid
Smiles: COc1cc(ccc1OC)c1c(nnn1c1nonc1N)C(=O)O

STK592895
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[2-(dimethylammonio)ethyl]-2-(3-hydroxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: C[NH+](CCN1C(c2cccc(c2)O)/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C1=O)C

STK592898
Synonyms: 2-({4-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1COc1ccc(cc1)C

STK592899
Synonyms: 8-(2-cyclohexylidenehydrazinyl)-6-hydroxy-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COc1ccc(cc1)CCn1c(NN=C2CCCCC2)nc2c1c(O)nc(=O)n2C

STK592902
Synonyms: 5,9-dimethyl-2-(pyridin-4-yl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)c1ccncc1

STK592904
Synonyms: N-[3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-(4-fluorophenyl)propyl]benzamide
Smiles: Fc1ccc(cc1)C(C1CCOC(C1)(C)C)CCNC(=O)c1ccccc1

STK592905
Synonyms: (5Z)-3-(2-chlorophenyl)-5-(pyridin-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Clc1ccccc1N1C(=S)S/C(=C\c2ccccn2)/C1=O

STK592907
Synonyms: 4-(3,4-dichlorophenyl)-N-(2-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccccc1NC(=O)c1n2cc(n3c2c(c1c1ccccc1)CCCC3)c1ccc(c(c1)Cl)Cl

STK592908
Synonyms: 5-(4-ethoxyphenyl)-4-{(2E)-2-[(5-methylthiophen-2-yl)methylidene]hydrazinyl}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1N/N=C/c1ccc(s1)C

STK592909
Synonyms: (5E)-5-({2,5-dimethyl-1-[3-nitro-4-(pyrrolidin-1-yl)phenyl]-1H-pyrrol-3-yl}methylidene)-6-hydroxy-3-(thiophen-2-ylmethyl)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\c2cc(n(c2C)c2ccc(c(c2)[N+](=O)[O-])N2CCCC2)C)/C(=O)N1Cc1cccs1

STK592911
Synonyms: 3-(2-methoxyethyl)-5-(propan-2-yl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl2-methylpropanoate
Smiles: COCCn1cc(c2c1nc(C(C)C)n1c2nc2c1cccc2)OC(=O)C(C)C

STK592912
Synonyms: 7-(4-chlorobenzyl)-8-(4-ethylpiperazin-1-yl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)Cl)c(=O)n(c(=O)n2C)C

STK592913
Synonyms: 3-{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: [O-]c1cccc(c1)n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=[NH2+])nc(s2)C

STK592914
Synonyms: (5E)-1-(4-chlorophenyl)-5-({[2-(piperazin-1-yl)ethyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C\NCCN2CCNCC2)/C1=O)S

STK592915
Synonyms: 10-(2-hydroxyphenyl)-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)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1ccccc1O

STK592916
Synonyms: 1,3-benzodioxol-5-yl(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)methanone
Smiles: O=C(c1ccc2c(c1)OCO2)N1CCC2(CC1)NCCc1c2[nH]cn1

STK592917
Synonyms: 2-[(3a'S,6a'R)-5'-butyl-5-chloro-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(Cl)cc2

STK592918
Synonyms: N-(2,4-difluorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK592919
Synonyms: N'-[(1E)-1-(biphenyl-4-yl)ethylidene]-5-(3-ethoxyphenyl)-1H-pyrazole-3-carbohydrazide
Smiles: CCOc1cccc(c1)c1[nH]nc(c1)C(=O)N/N=C(/c1ccc(cc1)c1ccccc1)\C

STK592920
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-1-(3-methylphenyl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Cc1cccc(c1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)[N+](=O)[O-]

STK592921
Synonyms: N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)/N=c/1\sc2c([nH]1)cccc2

STK592924
Synonyms: 2-{5-[(2-methylbenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Cc1ccccc1CSc1nnc(n1c1ccccc1)c1ccccn1

STK592925
Synonyms: 7-(4-chlorobenzyl)-10-methoxy-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-6(7H)-one
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2Cc1ccc(cc1)Cl

STK592927
Synonyms: N-(4-chlorophenyl)-2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK592929
Synonyms: 4-{[(E)-(5-bromo-2-fluorophenyl)methylidene]amino}-5-(2-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1ccc(c(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1C)F

STK592930
Synonyms: 6-ethyl-3-(2-fluorophenyl)-10-methyl-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: CCc1cc(=O)oc2c1cc1CN(COc1c2C)c1ccccc1F

STK592932
Synonyms: 4-(3,4-dimethylphenyl)-N-(3-methylphenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)C)n2c3c1CCCCn3c(c2)c1ccc(c(c1)C)C

STK592934
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK592936
Synonyms: 7-(2-chlorophenyl)-2-(3-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1cccc(c1)c1nc2n(n1)cnc1c2cnn1c1ccccc1Cl

STK592939
Synonyms: {[(4-fluorophenyl)amino][(4-methylbenzyl)sulfanyl]methylidene}propanedinitrile
Smiles: N#CC(=C(Nc1ccc(cc1)F)SCc1ccc(cc1)C)C#N

STK592940
Synonyms: (5E)-3-(4-chlorophenyl)-5-[1-(2,3-dihydro-1H-inden-5-ylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C(\Nc2ccc3c(c2)CCC3)/C)/C1=O)O

STK592941
Synonyms: 1-{1-[6-(4-ethylpiperazin-1-yl)pyrimidin-4-yl]-5-methyl-1H-pyrazol-4-yl}ethanone
Smiles: CCN1CCN(CC1)c1ncnc(c1)n1ncc(c1C)C(=O)C

STK592942
Synonyms: (3a'S,6a'R)-5-fluoro-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(F)cc2

STK592943
Synonyms: 3-[3-(azepan-1-yl)-3-oxopropyl]-1,2,3-benzotriazin-4(3H)-one
Smiles: O=C(N1CCCCCC1)CCn1nnc2c(c1=O)cccc2

STK592944
Synonyms: 1-methyl-3-nitro-4-(prop-2-en-1-ylamino)quinolin-2(1H)-one
Smiles: C=CCNc1c([N+](=O)[O-])c(=O)n(c2c1cccc2)C

STK592945
Synonyms: N-(4-methylphenyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: Cc1ccc(cc1)N(S(=O)(=O)c1ccccc1)Cc1cc2ccccc2[nH]c1=O

STK592946
Synonyms: 2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK592947
Synonyms: 3-(4-fluorobenzyl)-1-methyl-8-(2-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Fc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C

STK592948
Synonyms: (3R,3'R,4'S)-3''-benzyl-5-fluoro-1,1'-dimethyl-4'-(pyridin-2-yl)-2''-thioxo-4''H-dispiro[indole-3,2'-pyrrolidine-3',5''-[1,3]thiazolidine]-2,4''(1H)-dione
Smiles: Fc1ccc2c(c1)[C@@]1(N(C)C[C@H]([C@]31SC(=S)N(C3=O)Cc1ccccc1)c1ccccn1)C(=O)N2C

STK592949
Synonyms: 2,2,5-trimethyl-8-(piperidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCCCC1

STK592950
Synonyms: 1,6,6-trimethyl-3-phenyl-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: Cn1c2sc3c(c2c(=O)n(c1=O)c1ccccc1)CC(OC3)(C)C

STK592951
Synonyms: 1-(3-chlorophenyl)-4-(2,4,5-trimethoxyphenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1cc(OC)c(cc1C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)Cl)OC

STK592952
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)CC)nnc1COc1ccc(cc1)Cl

STK592953
Synonyms: (5s,7s)-5,7-diethyl-2-(4-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol
Smiles: CC[C@]12CN3C[C@@](C2O)(CN(C1)C3c1ccc(cc1)[N+](=O)[O-])CC

STK592956
Synonyms: 3-(2,4-dichlorobenzyl)-1,6,7,8-tetramethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1ccc(c(c1)Cl)Cn1c(=O)c2c(n(c1=O)C)nc1n2c(C)c(n1C)C

STK592957
Synonyms: (E)-1-(2-chlorophenyl)-N-{[8-(4-chlorophenyl)-11-(furan-2-yl)-10-methyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}methanimine
Smiles: Clc1ccc(cc1)n1nc(c2c1Oc1ncn3c(c1C2c1ccco1)nc(n3)CO/N=C/c1ccccc1Cl)C

STK592958
Synonyms: 4-benzyl1-(6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl)N-(tert-butoxycarbonyl)-D-aspartate
Smiles: CCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)[C@H](NC(=O)OC(C)(C)C)CC(=O)OCc1ccccc1

STK592959
Synonyms: N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]-5-{4-[(4-chlorobenzyl)oxy]phenyl}-1H-pyrazole-3-carbohydrazide
Smiles: Clc1ccc(cc1)COc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1cc(Br)ccc1O

STK592963
Synonyms: 3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2)/C1=O)C

STK592967
Synonyms: 8-(4-methoxyphenyl)-1-methyl-3-[(2E)-3-phenylprop-2-en-1-yl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)C/C=C/c1ccccc1

STK592968
Synonyms: N-(4-fluorophenyl)-N~2~-{[1-(L-phenylalanyl)piperidin-4-yl]carbonyl}-L-leucinamide
Smiles: CC(C[C@@H](C(=O)Nc1ccc(cc1)F)NC(=O)C1CCN(CC1)C(=O)[C@H](Cc1ccccc1)N)C

STK592969
Synonyms: 4-[(2E)-2-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)hydrazinyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N/N=C/c1ccc(o1)c1cccc(c1)C(F)(F)F

STK592970
Synonyms: N-(4-butylphenyl)-2-{[4-ethyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)CCCC)nnc1COc1ccccc1

STK592971
Synonyms: (10aS)-2-(3,4-dichlorophenyl)-10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione
Smiles: O=C1N2Cc3ccccc3C[C@H]2C(=O)N1c1ccc(c(c1)Cl)Cl

STK592972
Synonyms: 4-{[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]amino}-5-(2-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2c2ccccc2Br)cc(c1O)Br

STK592974
Synonyms: 3-methoxy-N-(2-methoxyethyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COCCN(C(=O)c1cccc(c1)OC)Cc1cc2ccccc2[nH]c1=O

STK592975
Synonyms: 8-chloro-2,2-dimethyl-5-(2-methylpropyl)-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)ncnc3Cl)C

STK592976
Synonyms: N-[(2E)-5,5-dioxido-3-[4-(propan-2-yl)phenyl]tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide
Smiles: CCC(=O)/N=C\1/SC2C(N1c1ccc(cc1)C(C)C)CS(=O)(=O)C2

STK592978
Synonyms: 1-{[1-(tert-butoxycarbonyl)-4-phenylpiperidin-4-yl]carbonyl}-L-prolyl-D-alanine
Smiles: OC(=O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)C

STK592981
Synonyms: N-[2-(morpholin-4-yl)ethyl]-8-propyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-amine
Smiles: CCCN1CCc2c(C1)sc1c2c(NCCN2CCOCC2)nc2n1nnn2

STK592982
Synonyms: 5-(4-methylphenyl)-4-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2c2ccc(cc2)C)cc(c1OC)OC

STK592983
Synonyms: 2,2'-{[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl]imino}diethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C)CCO

STK592984
Synonyms: 3-(3-chlorophenyl)-2-{[2-(2-hydroxyethoxy)ethyl]amino}-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: OCCOCCNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C

STK592986
Synonyms: (5s,7s)-2-(2,4-dichlorophenyl)-5-ethyl-7-methyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1ccc(cc1Cl)Cl)C

STK592987
Synonyms: N-[(2E)-3-(2,4-dimethoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclohexanecarboxamide
Smiles: COc1ccc(c(c1)OC)N1/C(=N\C(=O)C2CCCCC2)/SC2C1CS(=O)(=O)C2

STK592988
Synonyms: 5-bromo-2-methoxy-N-{[(2E)-4-(naphthalen-1-yl)-1,3-thiazol-2(3H)-ylidene]carbamothioyl}benzamide
Smiles: COc1ccc(cc1C(=O)NC(=S)/N=c\1/scc([nH]1)c1cccc2c1cccc2)Br

STK592989
Synonyms: 2-{1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetamide
Smiles: CC1CCN(CC1)Cc1nc2c(n1CC(=O)N)c(=O)n(c(=O)n2C)C

STK592990
Synonyms: N-(2-ethoxyphenyl)-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK592991
Synonyms: 2-(6-methoxy-1,3-benzothiazol-2-yl)-7-methyl-1-(4-methylphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)C)c(=O)c1c(o2)ccc(c1)C

STK592992
Synonyms: (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,3-dimethoxyphenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1cccc(c1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc2c(c1)OCO2

STK592994
Synonyms: 1,7-dimethyl-8-phenyl-3-(2-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1cn2c(n1c1ccccc1)nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK592995
Synonyms: N-[3-(3,4-dichlorophenyl)-4-oxo-4H-chromen-2-yl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1oc2ccccc2c(=O)c1c1ccc(c(c1)Cl)Cl

STK592997
Synonyms: 6-(3-chlorophenyl)-9-(pyridin-3-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Clc1cccc(c1)C1CC(=C2C(=Nc3n(C2c2cccnc2)ncn3)C1)O

STK592998
Synonyms: 1-(4-fluorophenyl)-N,4-bis(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)F)CCCC3)c1ccc(cc1)OC

STK593000
Synonyms: 4-[(3-ethoxypropyl)amino]-1-methyl-3-nitroquinolin-2(1H)-one
Smiles: CCOCCCNc1c([N+](=O)[O-])c(=O)n(c2c1cccc2)C

STK593002
Synonyms: (4-tert-butylphenyl)(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc(cc1)C(C)(C)C

STK593003
Synonyms: 2-(3-tert-butyl-4,9-dimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl)-N-cyclopropylacetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c1occ(c1c(c2)C)C(C)(C)C)NC1CC1

STK593005
Synonyms: 2-{4-[5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]furo[2,3-c]isoquinolin-8-yl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C

STK593006
Synonyms: 2-{[(6E)-4-amino-6-(phenylimino)-1,6-dihydro-1,3,5-triazin-2-yl]methoxy}benzaldehyde
Smiles: O=Cc1ccccc1OCc1nc(N)n/c(=N/c2ccccc2)/[nH]1

STK593007
Synonyms: N-[(2Z)-3-(4-acetylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: O=C(C(C)C)/N=C/1\SC2C(N1c1ccc(cc1)C(=O)C)CS(=O)(=O)C2

STK593008
Synonyms: N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Smiles: COc1ccc(cc1)N1CCN(CC1)CCCNS(=O)(=O)c1ccc2c(c1)oc(=O)n2C

STK593009
Synonyms: (5E)-6-hydroxy-5-[2-(morpholin-4-yl)-5-nitrobenzylidene]-3-(2-phenylethyl)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\c2cc(ccc2N2CCOCC2)[N+](=O)[O-])/C(=O)N1CCc1ccccc1

STK593011
Synonyms: 2-[(4-chlorophenoxy)methyl]-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1

STK593012
Synonyms: (4Z)-4-(3-bromo-4-nitrobenzylidene)-2-(thiophen-2-yl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(c(c1)Br)[N+](=O)[O-])c1cccs1

STK593015
Synonyms: N,N-diethyl-2-[(7-methyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Smiles: CCN(C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCN(C3)C)CC

STK593016
Synonyms: (4E)-6-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-4-[(3-methylphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Cc1cccc(c1)/N=c\1/nc(N)nc([nH]1)CN1CCN(CC1)Cc1ccc2c(c1)OCO2

STK593017
Synonyms: (4-{[(4-fluorophenyl)sulfonyl](methyl)amino}phenoxy)aceticacid
Smiles: OC(=O)COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)F)C

STK593018
Synonyms: 1-amino-4-[(3-methoxyphenyl)amino]-2-(propan-2-ylamino)anthracene-9,10-dione
Smiles: COc1cccc(c1)Nc1cc(NC(C)C)c(c2c1C(=O)c1ccccc1C2=O)N

STK593020
Synonyms: (3a'S,6a'R)-5'-cycloheptyl-3'-(1-hydroxyethyl)-5,7-dimethyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Cc1cc(C)c2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C1CCCCCC1)C(O)C)C(=O)N2

STK593021
Synonyms: 2-{[4-(4-chlorophenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK593024
Synonyms: (E)-N-{[8-(3-chlorophenyl)-11-(2-methoxyphenyl)-10-methyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}-1-phenylmethanimine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CO/N=C/c1ccccc1)c1cccc(c1)Cl

STK593025
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-N-(9,10-dimethoxy-4-oxo-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-2-yl)acetamide
Smiles: COc1cc2CCn3c(c2cc1OC)cc(nc3=O)N(c1cc(ccc1Cl)C(F)(F)F)C(=O)C

STK593026
Synonyms: 1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-yltrans-4-{[(tert-butoxycarbonyl)amino]methyl}cyclohexanecarboxylate
Smiles: O=C(OC(C)(C)C)NC[C@@H]1CC[C@H](CC1)C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK593027
Synonyms: 8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(CN2CCN(CC2)c2ccccc2F)nc2c1c(=O)n(c(=O)n2C)C)C

STK593028
Synonyms: (5Z)-4-hydroxy-5-({3-[2-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-1,3-thiazole-2(5H)-thione
Smiles: CC(Oc1ccc(c(c1)C)c1nn(cc1/C=C/1\SC(=S)N=C1O)c1ccccc1)C

STK593029
Synonyms: N-(3-fluorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1cccc(c1)F

STK593030
Synonyms: 2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK593031
Synonyms: 2,4-dichloro-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)/N=c\1/[nH]nc(s1)C

STK593033
Synonyms: N'-[(E)-(2-hydroxy-7-methoxyquinolin-3-yl)methylidene]-4-methylbenzenesulfonohydrazide
Smiles: COc1ccc2c(c1)nc(c(c2)/C=N/NS(=O)(=O)c1ccc(cc1)C)O

STK593036
Synonyms: morpholin-4-yl(4',5',8'-trimethyl-3',4'-dihydro-1'H-spiro[cyclohexane-1,2'-quinolin]-1'-yl)methanone
Smiles: O=C(N1c2c(C)ccc(c2C(CC21CCCCC2)C)C)N1CCOCC1

STK593037
Synonyms: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-N-(2,4,6-trichlorophenyl)acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1c(Cl)cc(cc1Cl)Cl

STK593038
Synonyms: 2-{[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-bromo-3-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)C)Br)CSc1nnc(n1N)c1n[nH]c(c1)C

STK593039
Synonyms: 8-[(4-fluorophenyl)sulfonyl]-7-methyl-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: Fc1ccc(cc1)S(=O)(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1

STK593042
Synonyms: N-[3-(diethylamino)propyl]-2-{[(2-methoxyphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: CCN(CCCNC(=O)c1c(sc2c1CCCC2)NC(=O)c1ccccc1OC)CC

STK593043
Synonyms: 8-(3-chloro-2-methylphenyl)-4-hydroxy-1,6,7-trimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Clc1cccc(c1C)n1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK593045
Synonyms: 2-({[4-methyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1H-benzimidazole
Smiles: Cc1cccc(c1)c1nnc(n1C)SCc1nc2c([nH]1)cccc2

STK593047
Synonyms: 8-(3-chlorophenyl)-11-(2-methoxyphenyl)-10-methyl-2-(pyridin-4-yl)-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)c1ccncc1)c1cccc(c1)Cl

STK593050
Synonyms: 5-bromo-N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}furan-2-carboxamide
Smiles: Clc1cc(c2n(c1)c(CNC(=O)c1ccc(o1)Br)nn2)C(F)(F)F

STK593051
Synonyms: 2,2-diethyl-5-methyl-4-phenyl-2,5-dihydro-1H-imidazol-1-ol3-oxide
Smiles: CCC1(CC)N(O)C(C(=[N+]1[O-])c1ccccc1)C

STK593052
Synonyms: N-[2-(4-chlorophenyl)-4-(4-methoxyphenyl)-6-methyl-5-oxo-2,5-dihydropyridazin-3-yl]benzamide
Smiles: COc1ccc(cc1)c1c(NC(=O)c2ccccc2)n(nc(c1=O)C)c1ccc(cc1)Cl

STK593053
Synonyms: 6-benzyl-1-(4-chlorophenyl)-2-hydroxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Clc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)Cc1ccccc1

STK593054
Synonyms: 3-(3-bromo-4-fluorophenyl)-5-(naphthalen-1-yl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: O=C1C2C(c3ccc(c(c3)Br)F)N(OC2C(=O)N1c1cccc2c1cccc2)c1ccccc1

STK593056
Synonyms: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3,4-diethoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C

STK593058
Synonyms: N-butyl-4-methyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: CCCCN(S(=O)(=O)c1ccc(cc1)C)Cc1cc2ccccc2[nH]c1=O

STK593060
Synonyms: 2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(F)(F)F)nnc1c1ccccn1

STK593061
Synonyms: 7-(5-chloro-2-methoxyphenyl)-3-(3-nitrophenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: COc1ccc(cc1N1C(=O)CC2(C1=O)ON=C(C2)c1cccc(c1)[N+](=O)[O-])Cl

STK593063
Synonyms: (2S)-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CC([C@H](n1nnc2c(c1=O)cccc2)C(=O)/N=c\1/sc2c([nH]1)cccc2)C

STK593064
Synonyms: 6,7-dimethoxy-2-[(2,3,5,6-tetramethylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)S(=O)(=O)c1c(C)c(C)cc(c1C)C

STK593066
Synonyms: 6-chloro-2-oxo-4-propyl-2H-chromen-7-ylN-[(benzyloxy)carbonyl]glycinate
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)CNC(=O)OCc1ccccc1

STK593067
Synonyms: (3S,3a'R,8a'S,8b'S)-7-chloro-5-methyl-2'-[3-(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: Cc1cc(Cl)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F

STK593068
Synonyms: 7-chloro-1-(3-hydroxyphenyl)-6-methyl-2-[3-(propan-2-yloxy)propyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CC(OCCCN1C(=O)c2c(C1c1cccc(c1)O)c(=O)c1c(o2)cc(c(c1)Cl)C)C

STK593070
Synonyms: 5-benzyl-3-(3,5-dichloro-2-hydroxyphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Clc1cc(Cl)c(c(c1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)Cc1ccccc1)O

STK593071
Synonyms: 2-(4-methoxyphenyl)-N-(5-methyl-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide
Smiles: COc1ccc(cc1)CC(=O)Nc1nn2c(n1)NC(CC2c1ccccc1)C

STK593072
Synonyms: N-(1,3-benzodioxol-5-yl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK593074
Synonyms: 1-[N-(2,5-dimethoxyphenyl)-N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-phenylurea
Smiles: COc1ccc(c(c1)N/C(=N\c1nc(C)cc(n1)C)/NC(=O)Nc1ccccc1)OC

STK593075
Synonyms: 6-hydroxy-3-methyl-8-[4-(3-methylbenzyl)piperazin-1-yl]-7-(3-methylbutyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1cccc(c1)C)C

STK593077
Synonyms: 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(OC)cc(c2)OC)nnc1c1ccc(cc1)C(C)(C)C

STK593080
Synonyms: N-[4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-yl]ethane-1,2-diamine
Smiles: NCCNc1ncnc2c1oc1c2c2CCCc2c(n1)CC(C)C

STK593083
Synonyms: ethyl3'-(3-chlorophenyl)-3,3-bis(4-chlorophenyl)-3H,3'H-spiro[2-benzothiophene-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)SC(c1c2cccc1)(c1ccc(cc1)Cl)c1ccc(cc1)Cl)c1cccc(c1)Cl

STK593084
Synonyms: 1-(4-bromophenyl)-7-fluoro-2-(6-methylpyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Brc1ccc(cc1)C1N(c2cccc(n2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK593085
Synonyms: 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-[(2E)-6-nitro-1,3-benzothiazol-2(3H)-ylidene]acetamide
Smiles: O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)/N=c\1/sc2c([nH]1)ccc(c2)[N+](=O)[O-]

STK593086
Synonyms: 3-(pyridin-2-ylmethyl)-3,4-dihydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Smiles: O=c1oc2c3CN(COc3ccc2c2c1cccc2)Cc1ccccn1

STK593087
Synonyms: 6-amino-3-(pyridin-4-yl)-4-(thiophen-3-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cscc1)c(n[nH]2)c1ccncc1

STK593088
Synonyms: (5E)-5-[(5-chlorothiophen-2-yl)methylidene]-2-hydroxy-3-(4-methylbenzyl)-3,5-dihydro-4H-imidazol-4-one
Smiles: Cc1ccc(cc1)CN1C(=N/C(=C/c2ccc(s2)Cl)/C1=O)O

STK593090
Synonyms: N-(5-chloro-2,4-dimethoxyphenyl)-6-(4-oxoquinazolin-3(4H)-yl)hexanamide
Smiles: COc1cc(OC)c(cc1NC(=O)CCCCCn1cnc2c(c1=O)cccc2)Cl

STK593091
Synonyms: N-(2-fluorophenyl)-4-hydroxy-3,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: O=C(c1oc2c(c1C)C(O)CC(C2)(C)C)Nc1ccccc1F

STK593092
Synonyms: 2-cyclohexyl-3-(2-methoxyethyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)C1CCCCC1

STK593093
Synonyms: methyl2-amino-4-(2,5-dichlorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: COC(=O)C1=C(N)Oc2c(C1c1cc(Cl)ccc1Cl)oc(cc2=O)CO

STK593094
Synonyms: 6-chloro-2-[(3,4-dimethoxybenzyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: COc1cc(CNc2nn3c(n2)nc(c(c3O)Cl)C)ccc1OC

STK593097
Synonyms: N-(2-ethyl-6-methylphenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1c1ccccc1)c1ccccn1)C

STK593101
Synonyms: 2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK593102
Synonyms: 6-(furan-2-ylmethyl)-1-(4-methoxyphenyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)Cc1ccco1

STK593106
Synonyms: 2-(4-tert-butylphenyl)-3-cyclopentyl-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: Cn1c2nc(c3ccc(cc3)C(C)(C)C)n(c(=O)c2c(=O)c2c1cccc2)C1CCCC1

STK593107
Synonyms: 5-{3-[(4-chlorobenzyl)oxy]phenyl}-N'-[(E)-furan-2-ylmethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: Clc1ccc(cc1)COc1cccc(c1)c1[nH]nc(c1)C(=O)N/N=C/c1ccco1

STK593109
Synonyms: N-(2-methoxyethyl)-4-methyl-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: COCCN(S(=O)(=O)c1ccc(cc1)C)Cc1cc2cc(C)ccc2[nH]c1=O

STK593110
Synonyms: N-(3,5-dichlorophenyl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK593112
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: COc1cc(CCNc2ncnc3c2oc2c3c3CC(C)(C)OCc3c(n2)C)ccc1OC

STK593113
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(2,4,6-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(OC)cc(c1/C=N/n1c(=S)[nH]nc1c1ccccc1Cl)OC

STK593115
Synonyms: 8-(4-benzylpiperidin-1-yl)-7-ethyl-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)Cc1ccccc1

STK593118
Synonyms: 8-(4-chlorophenyl)-2-(furan-2-yl)-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)c1ccco1)c1ccc(cc1)Cl

STK593119
Synonyms: {4-[5-methyl-3-phenyl-6-(prop-2-en-1-yl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl}acetonitrile
Smiles: C=CCc1c(C)nc2n(c1N1CCN(CC1)CC#N)ncc2c1ccccc1

STK593121
Synonyms: N'-[(E)-(3-chlorophenyl)methylidene]-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carbohydrazide
Smiles: Clc1cccc(c1)/C=N/NC(=O)c1c(O)c2ccccc2n(c1=O)C

STK593122
Synonyms: 3-(4-fluorobenzyl)-1,6,7-trimethyl-8-(tetrahydrofuran-2-ylmethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Fc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)CC1CCCO1

STK593123
Synonyms: 8-(2-methoxyphenyl)-1-methyl-3-[(2E)-3-phenylprop-2-en-1-yl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)C/C=C/c1ccccc1

STK593125
Synonyms: N-(3-chloro-2-methylphenyl)-2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2C)Cl)nnc1COc1ccc(cc1)Cl

STK593126
Synonyms: N-(1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)-N-propylbenzenesulfonamide
Smiles: CCCN(S(=O)(=O)c1ccccc1)c1nc2ccccc2n2c1nnc2CC

STK593127
Synonyms: N-[(2E)-3-(3,5-dichlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methoxyacetamide
Smiles: COCC(=O)/N=C\1/SC2C(N1c1cc(Cl)cc(c1)Cl)CS(=O)(=O)C2

STK593128
Synonyms: 4-[(E)-[2-(4-tert-butylphenyl)-1-(2-methoxyethyl)-4,5-dioxopyrrolidin-3-ylidene](hydroxy)methyl]-N,N-dimethylbenzenesulfonamide
Smiles: COCCN1C(c2ccc(cc2)C(C)(C)C)/C(=C(/c2ccc(cc2)S(=O)(=O)N(C)C)\O)/C(=O)C1=O

STK593129
Synonyms: 2-{[6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)hexanoyl]amino}benzamide
Smiles: O=C(Nc1ccccc1C(=O)N)CCCCCn1nnc2c(c1=O)cccc2

STK593130
Synonyms: ethyl2-[(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccccc1C)NC1OC(=O)c2c1ccc(c2OC)OC

STK593131
Synonyms: 3-amino-6-benzyl-N-(3,4-dimethoxyphenyl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)c1sc2c(c1N)c(cc(n2)Cc1ccccc1)C(F)(F)F

STK593134
Synonyms: 3-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-(pyridin-2-ylmethyl)propanamide
Smiles: O=C(NCc1ccccn1)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C

STK593136
Synonyms: 7-hydroxy-1-methyl-2-(prop-2-en-1-ylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: COc1cc(cc(c1OC)OC)C1CC(=Nc2c1c(=O)nc(n2C)SCC=C)O

STK593137
Synonyms: 9-chloro-2-phenyl-5-(3,4,5-trimethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1cc(cc(c1OC)OC)C1Oc2ccc(cc2C2N1N=C(C2)c1ccccc1)Cl

STK593138
Synonyms: 1,3-dimethyl-5-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-ylsulfonyl)pyrimidine-2,4(1H,3H)-dione
Smiles: O=c1n(C)cc(c(=O)n1C)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK593139
Synonyms: (6-chloropyridin-3-yl)(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)c1ccc(nc1)Cl

STK593140
Synonyms: (4E)-4-[hydroxy(4-nitrophenyl)methylidene]-1,5-bis(4-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C(=O)N1c1ccc(cc1)OC

STK593142
Synonyms: 2-[(3aR,4R,4aR,7aS,8R,8aR)-3-(2,4-dimethoxyphenyl)-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]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: COc1ccc(c(c1)OC)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1sc2c(c1C#N)CCCC2

STK593144
Synonyms: methylN-[(4-chlorophenyl)carbamoyl]-D-valinate
Smiles: COC(=O)[C@@H](C(C)C)NC(=O)Nc1ccc(cc1)Cl

STK593145
Synonyms: ethyl4-[(3a'S,6a'R)-3'-(2-amino-2-oxoethyl)-5-fluoro-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]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(F)cc2

STK593147
Synonyms: (4E)-4-[hydroxy(4-methylphenyl)methylidene]-5-(4-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)[N+](=O)[O-])N(C(=O)C1=O)c1cccc(c1)C(F)(F)F)/O

STK593151
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3,4-dimethoxyphenyl)carbonyl]-2'-[(2-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cc(ccc1OC)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1OC)C(=O)Nc1c2cccc1)cccc3

STK593153
Synonyms: (2Z)-2-(1H-benzimidazol-2-yl)-3-(4-fluorophenyl)-3-hydroxyprop-2-enenitrile
Smiles: N#C/C(=C(\c1ccc(cc1)F)/O)/c1nc2c([nH]1)cccc2

STK593154
Synonyms: (3a'R,8b'S)-7-ethyl-2'-(3-methoxypropyl)-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: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(N3C2CCC3)C(=O)Nc2c1cccc2CC

STK593155
Synonyms: 8-[4-(3-chlorobenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-(2-methylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1cccc(c1)Cl)C

STK593156
Synonyms: (E)-{1'-[3-(dimethylammonio)propyl]-2,4',5'-trioxo-1-(prop-2-en-1-yl)-1,2-dihydro-3'H-spiro[indole-3,2'-pyrrolidin]-3'-ylidene}(4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C21C(=O)N(c1c2cccc1)CC=C)CCC[NH+](C)C)/[O-]

STK593157
Synonyms: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{4,5-dioxo-2-[3-(pentyloxy)phenyl]-1-(pyridinium-4-ylmethyl)pyrrolidin-3-ylidene}methanolate
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1Cc1cc[nH+]cc1

STK593158
Synonyms: N-[4-(acetylamino)phenyl]-2-{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)NC(=O)C)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)Cl

STK593159
Synonyms: (2E)-3-(3-bromophenyl)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)prop-2-en-1-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)/C=C/c1cccc(c1)Br

STK593160
Synonyms: 2,12,12-trimethyl-7-(prop-2-en-1-ylsulfanyl)-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: C=CCSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CC(OC3)(C)C

STK593161
Synonyms: (6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)[4-(piperidin-1-ylsulfonyl)phenyl]methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1

STK593162
Synonyms: 10-methyl-2-(2-methylphenyl)-3-propylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccccc1C

STK593163
Synonyms: 2-(6-methyl-1,3-benzothiazol-2-yl)-1-(5-methylfuran-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc(o1)C1N(c2nc3c(s2)cc(cc3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593164
Synonyms: N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-1,7-dimethyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: Cc1cc(C)nc(n1)NS(=O)(=O)c1ccc(cc1)NC(=O)c1cc2c(n1C)nc1n(c2=O)cc(cc1)C

STK593165
Synonyms: N-benzyl-2-(6-oxo-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-7(6H)-yl)acetamide
Smiles: O=C(Cn1c2ccccc2c2c1c(=O)n1CCCSc1n2)NCc1ccccc1

STK593166
Synonyms: N'-[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl]-N,N-diethylethane-1,2-diamine
Smiles: CCN(CCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C)CC

STK593168
Synonyms: N-(3-methoxyphenyl)-4-phenyl-1-[4-(propan-2-yl)phenyl]-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1cccc(c1)NC(=O)c1c(c2ccc(cc2)C(C)C)c2c3n1cc(n3CCCC2)c1ccccc1

STK593169
Synonyms: (1S,2S)-N'-[(E)-2H-chromen-3-ylmethylidene]-2-phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/C1=Cc2c(OC1)cccc2

STK593170
Synonyms: (5Z)-5-(3,4-dimethoxybenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1,3-thiazol-4(5H)-one
Smiles: COc1cc(ccc1OC)/C=C/1\SC(=NC1=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STK593171
Synonyms: N-(3-chlorophenyl)-2-{[4-(4-chlorophenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK593172
Synonyms: N-{4-[(3a'S,6a'R)-3'-(1H-indol-3-ylmethyl)-6,7-dimethyl-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]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1ccc(c2C)C

STK593173
Synonyms: tert-butyl(3S)-3-[(2-hydroxy-2-phenylethyl)carbamoyl]-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: O=C(N1Cc2ccccc2C[C@H]1C(=O)NCC(c1ccccc1)O)OC(C)(C)C

STK593175
Synonyms: methylN-{(E)-[1-(3-chlorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=NC(=O)N(C1=O)c1cccc(c1)Cl)O

STK593176
Synonyms: 4-imino-9,10-dimethoxy-2-(3-methylthiophen-2-yl)-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: COc1cc2CCn3c(c2cc1OC)cc(c(c3=N)C#N)c1sccc1C

STK593178
Synonyms: 8-(hexylsulfanyl)-6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCCSc1nc2c(n1CC(=C)C)c(O)nc(=O)n2C

STK593179
Synonyms: 6-cyclohexyl-1-(4-methoxyphenyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)C1CCCCC1

STK593181
Synonyms: 1-(2,3-dimethylphenyl)-2-hydroxy-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CC(N1CNc2c(C1)c(=O)nc(n2c1cccc(c1C)C)O)C

STK593186
Synonyms: N-(2-ethoxyphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccccn1

STK593189
Synonyms: 1-amino-8,8-dimethyl-N-(2-nitrophenyl)-5-(pyrrolidin-1-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCCC1)Nc1ccccc1[N+](=O)[O-]

STK593192
Synonyms: 1-[3-(7-methyl-6H-indolo[2,3-b]quinoxalin-6-yl)propyl]-1H-indole-2,3-dione
Smiles: O=C1c2ccccc2N(C1=O)CCCn1c2nc3ccccc3nc2c2c1c(C)ccc2

STK593194
Synonyms: 3-(2-methoxyethyl)-2-(thiophen-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1cccs1

STK593196
Synonyms: ethyl1-(2-oxo-2-{[(2Z)-4-phenyl-1,3-thiazol-2(3H)-ylidene]amino}ethyl)piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CC(=O)/N=c/1\scc([nH]1)c1ccccc1

STK593197
Synonyms: N-(3,4-dichlorophenyl)-6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]hexanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK593198
Synonyms: 3-hexyl-8-methoxy-2-(4-methoxyphenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: CCCCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cc(cc1)OC)c1ccc(cc1)OC

STK593199
Synonyms: 5,7-dichloro-1-(2-methoxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccccc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c(Cl)cc(c1)Cl

STK593201
Synonyms: N-(3-fluorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)acetamide
Smiles: Fc1cccc(c1)NC(=O)Cn1c(O)nc2c(c1=O)cccc2

STK593202
Synonyms: 1-tert-butyl4-(6-chloro-4-methyl-2-oxo-2H-chromen-7-yl)piperidine-1,4-dicarboxylate
Smiles: O=C(C1CCN(CC1)C(=O)OC(C)(C)C)Oc1cc2oc(=O)cc(c2cc1Cl)C

STK593203
Synonyms: 3-(2-hydroxyphenyl)-1-(1H-indol-3-ylmethyl)-5-(3-methylphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: Cc1cccc(c1)N1C(=O)C2C(C1=O)C(NC2c1ccccc1O)(Cc1c[nH]c2c1cccc2)C(=O)O

STK593204
Synonyms: cyclohexyl(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)C1CCCCC1

STK593205
Synonyms: methyl4-[(2-{5-[(1,3-benzodioxol-5-ylcarbonyl)amino]-3-methyl-1H-pyrazol-1-yl}-1H-benzimidazol-1-yl)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)Cn1c(nc2c1cccc2)n1nc(cc1NC(=O)c1ccc2c(c1)OCO2)C

STK593207
Synonyms: 1-ethyl-2-methyl-6-nitro-1,4-dihydroquinoline-3,3(2H)-dicarboxylicacid
Smiles: CCN1c2ccc(cc2CC(C1C)(C(=O)O)C(=O)O)[N+](=O)[O-]

STK593210
Synonyms: N-(3-acetylphenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1cnc2c(c1=O)cccc2)Nc1cccc(c1)C(=O)C

STK593211
Synonyms: 2-(ethylsulfanyl)-6,6-dimethyl-9-(3-methylthiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CC(C1)(C)C)C2c1sccc1C

STK593214
Synonyms: 4-(2-fluorophenyl)-5-(3-phenyl-1H-pyrazol-5-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccccc1n1c(=S)[nH]nc1c1[nH]nc(c1)c1ccccc1

STK593216
Synonyms: 2-[(2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]-N-(pyridin-3-ylmethyl)propanamide
Smiles: O=C(C(Oc1cc2oc(=O)c3c(c2cc1Cl)CCCC3)C)NCc1cccnc1

STK593218
Synonyms: 2-(6-chloro-1,3-benzothiazol-2-yl)-1-(2-fluorophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1F)c(=O)c1c(o2)cccc1

STK593219
Synonyms: 2-(6-methyl-1,3-benzothiazol-2-yl)-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)C)C(=O)c2c1c(=O)c1c(o2)cccc1)C

STK593220
Synonyms: 9-methyl-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: C=CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2)/C1=O

STK593223
Synonyms: 1-(4-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)-3-(4-methylphenyl)guanidine
Smiles: Oc1nc(nc(c1)CSc1nnc(s1)N)NC(=N)Nc1ccc(cc1)C

STK593224
Synonyms: (5-methoxy-3-methyl-1H-indol-2-yl)[4-(2-methoxyphenyl)piperazin-1-yl]methanone
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)N1CCN(CC1)c1ccccc1OC

STK593226
Synonyms: (2Z)-1-[4-(difluoromethoxy)-3-methoxyphenyl]-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)ethanone
Smiles: COc1cc(ccc1OC(F)F)C(=O)/C=C/1\NCCc2c1cc(OC)c(c2)OC

STK593227
Synonyms: 4-{[(E)-(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-5-(furan-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1cc(/C=N/n2c(=S)[nH]nc2c2ccco2)c(c(c1)Br)O

STK593228
Synonyms: 2-(4-fluorophenyl)-N-[(2E)-3-(4-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: Fc1ccc(cc1)CC(=O)/N=C\1/SC2C(N1c1ccc(cc1)F)CS(=O)(=O)C2

STK593229
Synonyms: 4-chloro-N-(4-methoxyphenyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)Cl)Cc1cc2ccccc2[nH]c1=O

STK593231
Synonyms: N-(2-bromophenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1Br)CSc1nnc(n1c1ccccc1)c1cnccn1

STK593233
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxyphenyl)-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccccc2F)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK593234
Synonyms: 5-(4-fluorophenyl)-4-{[(E)-(2-fluorophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccc1F

STK593235
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-propoxyphenyl)-N'-{(E)-[3-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)C(F)(F)F

STK593236
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(4-methoxyphenyl)carbonyl]-3'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccs2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK593237
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(4-methylphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl

STK593238
Synonyms: 2-(morpholin-4-yl)-3-(2-phenylethyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: O=c1n(CCc2ccccc2)c(nc2c1c1CCCCCc1s2)N1CCOCC1

STK593239
Synonyms: (3a'S,6a'R)-5'-(4-fluorobenzyl)-3'-(1-hydroxyethyl)-6,7-dimethyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1ccc(c2C)C

STK593240
Synonyms: (4E)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)c1nc2c(s1)cc(cc2)F)/O

STK593242
Synonyms: N-(3-ethoxypropyl)-2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CCOCCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C(C)C

STK593243
Synonyms: 8,8-dimethyl-4-(piperazin-1-yl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC1(C)OCc2c(C1)nc1c(c2)c2c(o1)c(ncn2)N1CCNCC1

STK593244
Synonyms: (5E)-5-[1-(hexylamino)propylidene]-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CCCCCCN/C(=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/CC

STK593247
Synonyms: 2-[(2E)-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)hydrazinylidene]-2,3-dihydro-1H-benzimidazole
Smiles: C1COc2c(O1)cc(cc2)/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK593249
Synonyms: 4-{[(E)-(5-bromo-2-methoxyphenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1/C=N/n1c(=S)[nH]nc1c1ccccn1)Br

STK593251
Synonyms: 5-(3,4-dichlorophenyl)-N'-[(1E)-1-(4-methoxyphenyl)ethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)c1n[nH]c(c1)c1ccc(c(c1)Cl)Cl)/C

STK593253
Synonyms: (5E)-3-(4-ethylphenyl)-6-hydroxy-5-({[2-(piperidin-1-yl)ethyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: CCc1ccc(cc1)N1C(=O)N=C(/C(=C\NCCN2CCCCC2)/C1=O)O

STK593254
Synonyms: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-4-(4-methylphenyl)butane-1,4-dione
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CCC(=O)c1ccc(cc1)C

STK593255
Synonyms: N-[(2E)-3-(4-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclohexanecarboxamide
Smiles: COc1ccc(cc1)CN1/C(=N\C(=O)C2CCCCC2)/SC2C1CS(=O)(=O)C2

STK593256
Synonyms: 3-(3,4-dimethoxyphenyl)-7-(4-methoxyphenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: COc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1ccc(c(c1)OC)OC

STK593257
Synonyms: ethyl6'-amino-5-methoxy-3'-methyl-2-oxo-1'-phenyl-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C31C(=O)Nc1c3cc(OC)cc1)c(C)nn2c1ccccc1

STK593258
Synonyms: (2E)-3-(2-chlorophenyl)-N-[(2Z)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]prop-2-enamide
Smiles: COc1ccc2c(c1)s/c(=N\C(=O)/C=C/c1ccccc1Cl)/[nH]2

STK593263
Synonyms: 4-[(E)-{[3-(4-tert-butylphenyl)-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]nc1c1ccc(cc1)C(C)(C)C

STK593266
Synonyms: N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-5-(furan-2-ylmethyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: c1coc(c1)CN1CNC(=NC1)/N=c/1\sc2c([nH]1)cccc2

STK593267
Synonyms: N-[3,5-bis(trifluoromethyl)phenyl]-2-{[5-(2-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)nnc1c1ccccc1C

STK593268
Synonyms: 2-{[4-amino-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-bromophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK593269
Synonyms: (1S)-1-{5-[(3,4-dichlorobenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}-2-methylpropan-1-amine
Smiles: CC([C@@H](c1nnc(o1)S(=O)(=O)Cc1ccc(c(c1)Cl)Cl)N)C

STK593270
Synonyms: 3-[(2E)-2-{[1-(2-fluorobenzyl)-1H-indol-3-yl]methylidene}hydrazinyl]-5H-[1,2,4]triazino[5,6-b]indole
Smiles: Fc1ccccc1Cn1cc(c2c1cccc2)/C=N/Nc1nnc2c(n1)[nH]c1c2cccc1

STK593271
Synonyms: 2-(3-chlorophenyl)-5-[2-(methylsulfanyl)ethyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: CSCCC1Oc2ccccc2C2N1N=C(C2)c1cccc(c1)Cl

STK593272
Synonyms: 2-{[4-(4-methoxyphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C)nnc1Cc1cccs1

STK593273
Synonyms: (5E)-6-hydroxy-5-{1-[(3-hydroxypropyl)amino]ethylidene}-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: OCCCN/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/C

STK593274
Synonyms: 2-(2-bromophenoxy)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Smiles: COc1cc2c(cc1OC)CCn1c2cc(Oc2ccccc2Br)nc1=O

STK593275
Synonyms: ethylN-[({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]glycinate
Smiles: CCOC(=O)CNC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)C

STK593277
Synonyms: N-[4-(butan-2-yl)phenyl]-2-{[5-(2-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1F)C

STK593278
Synonyms: (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: CC1Cc2c(O1)ccc(c2)/C(=C\1/C(c2ccc(cc2)C(C)C)N(C(=O)C1=O)c1nnc(s1)C)/O

STK593279
Synonyms: (5E)-5-{[1-(4-fluorobenzyl)-1H-indol-3-yl]methylidene}-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Fc1ccc(cc1)Cn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccco1)O

STK593280
Synonyms: 2-{(2E)-[(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)methylidene]hydrazinylidene}-2,3-dihydro-1H-benzimidazole
Smiles: COc1ccc2c(c1)c(/C=N/N=c/1\[nH]c3c([nH]1)cccc3)c(n2Cc1ccccc1)C

STK593281
Synonyms: 2-[(2-methoxyethyl)amino]-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COCCNc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCCC3

STK593282
Synonyms: 4-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1c(F)cccc1Cl

STK593284
Synonyms: 4-{[(2'S,3S,3'S,10b'R)-2-oxo-2'-(thiophen-2-ylcarbonyl)-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl]carbonyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccs1)C(=O)Nc1c2cccc1)cccc3

STK593285
Synonyms: 7-(3,4-dichlorophenyl)-3-(pyridin-3-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1ccc(cc1Cl)n1ncc2c1ncn1c2nnc1c1cccnc1

STK593286
Synonyms: (1'R,2'R)-2'-(3-chlorophenyl)-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)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1cccc(c1)Cl)C(=O)c1c(C2=O)cccc1

STK593289
Synonyms: 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}-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc2n1c(Nc1ccccc1)c(C#N)c1c2COC(C1)(C)C

STK593291
Synonyms: N-(3,4-dimethoxyphenyl)-2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1OC)NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK593292
Synonyms: methylN-[(3,4-dimethoxybenzyl)carbamoyl]-D-phenylalaninate
Smiles: COC(=O)[C@@H](Cc1ccccc1)NC(=O)NCc1ccc(c(c1)OC)OC

STK593293
Synonyms: 1-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)propan-2-one
Smiles: CC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK593294
Synonyms: N'-[(E)-{4-[bis(2-chloroethyl)amino]phenyl}methylidene]-4,5-dihydro-2H-benzo[g]indazole-3-carbohydrazide
Smiles: ClCCN(c1ccc(cc1)/C=N/NC(=O)c1[nH]nc2c1CCc1c2cccc1)CCCl

STK593295
Synonyms: N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(4-methylphenyl)benzenesulfonamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccccc1)c1ccc(cc1)C

STK593297
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Smiles: CC(CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O)C

STK593299
Synonyms: (5Z)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C(=N1)O

STK593300
Synonyms: N-[(2E)-5-({2-[(4-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-(4-oxoquinazolin-3(4H)-yl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1n[nH]/c(=N\C(=O)Cn2cnc3c(c2=O)cccc3)/s1

STK593303
Synonyms: 3-[(2-methylprop-2-en-1-yl)sulfanyl]-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-4-amine
Smiles: CC(=C)CSc1nnc(n1N)c1n[nH]c(c1)C

STK593304
Synonyms: N-(2,4-dichlorophenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc(n1c1ccccc1)c1nccnc1

STK593305
Synonyms: 3-(1H-benzimidazol-2-yl)-N-[3-(propan-2-yloxy)propyl]propanamide
Smiles: O=C(CCc1nc2c([nH]1)cccc2)NCCCOC(C)C

STK593308
Synonyms: methyl3-[8-(3-chlorophenyl)-1,7-dimethyl-2,4-dioxo-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]propanoate
Smiles: COC(=O)CCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1cccc(c1)Cl)C

STK593309
Synonyms: 2-({[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1H-benzimidazole
Smiles: Cc1ccc(cc1)n1c(SCc2nc3c([nH]2)cccc3)nnc1c1cccc(c1)Cl

STK593310
Synonyms: 10-(2-chlorophenyl)-9-hydroxy-7,7-dimethyl-6,7,8,10-tetrahydro-11H-indeno[1,2-b]quinolin-11-one
Smiles: OC1=C2C(=NC3=C(C2c2ccccc2Cl)C(=O)c2c3cccc2)CC(C1)(C)C

STK593312
Synonyms: N-(3-fluorophenyl)-2-{[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1c1cccc(c1)OC

STK593313
Synonyms: 2-({6-cyano-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)-N-(4-methoxyphenyl)acetamide
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)Nc3ccc(cc3)OC)nnc2c2c1CC(C)(C)OC2

STK593314
Synonyms: N-[3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl]-N'-(4-methylphenyl)quinoxaline-2,3-diamine
Smiles: Cc1ccc(cc1)Nc1nc2ccccc2nc1Nc1cc(nn1c1ccc(cc1)[N+](=O)[O-])C

STK593315
Synonyms: 1-[(7-benzyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)methyl]piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)Cc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK593316
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK593317
Synonyms: 8-(azepan-1-yl)-6-hydroxy-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCCCCC1)COc1cccc(c1)C

STK593322
Synonyms: N'-[(6-bromo-2-methoxynaphthalen-1-yl)acetyl]-4-fluorobenzohydrazide
Smiles: COc1ccc2c(c1CC(=O)NNC(=O)c1ccc(cc1)F)ccc(c2)Br

STK593324
Synonyms: 2-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-N-phenylhydrazinecarbothioamide
Smiles: C=CCN1C(=NC(=O)/C(=C\NNC(=S)Nc2ccccc2)/C1=O)S

STK593325
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-phenylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccccc1

STK593326
Synonyms: 3-(3-bromo-4-fluorophenyl)-5-(4-chlorophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(c(c1)Br)F

STK593328
Synonyms: 2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(propan-2-yl)phenyl]acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)C)nnc1COc1ccccc1

STK593331
Synonyms: (5E)-6-hydroxy-5-{1-[(3-hydroxypropyl)amino]propylidene}-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: OCCCN/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/CC

STK593332
Synonyms: 7-(2,6-dichlorobenzyl)-8-(4-ethylpiperazin-1-yl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCN1CCN(CC1)c1nc2c(n1Cc1c(Cl)cccc1Cl)c(O)nc(=O)n2C

STK593333
Synonyms: 4-[(3a'S,6a'R)-3'-(1H-indol-3-ylmethyl)-7-methyl-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)Nc2c1cccc2C

STK593334
Synonyms: N-[(3Z)-1-ethyl-7-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-2-nitrobenzenesulfonamide
Smiles: CCn1[nH]/c(=N\S(=O)(=O)c2ccccc2[N+](=O)[O-])/c2c1nc1cc(C)ccc1c2

STK593337
Synonyms: N-ethyl-N-[(2-hydroxyquinolin-4-yl)methyl]benzamide
Smiles: CCN(C(=O)c1ccccc1)Cc1cc(O)nc2c1cccc2

STK593338
Synonyms: 2'-hydroxy-13-methyl-1'-pentyl-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: CCCCCN1C(=NC(=O)C2(C1=O)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C)O

STK593339
Synonyms: (5E)-3-tert-butyl-6-hydroxy-5-{[(2-hydroxyethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: OCCN/C=C/1\C(=NC(=O)N(C1=O)C(C)(C)C)O

STK593340
Synonyms: N-(3-chlorophenyl)-2-{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)Cl)N=C2C(=C(O)CCC2)C1c1ccc(cc1)Cl

STK593342
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccc(cc2)Cl)c2cccc(c2)Cl)cc(c1)OC

STK593343
Synonyms: 2-(4-methylphenyl)-5-[2-(methylsulfanyl)ethyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: CSCCC1Oc2ccccc2C2N1N=C(C2)c1ccc(cc1)C

STK593344
Synonyms: N-[4-({(4E)-2-[4-(methylsulfanyl)phenyl]-4H-chromen-4-ylidene}amino)phenyl]acetamide
Smiles: CSc1ccc(cc1)c1c/c(=N\c2ccc(cc2)NC(=O)C)/c2c(o1)cccc2

STK593345
Synonyms: 8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-[2-(morpholin-4-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CC(C)CN(C1)Cc1nc2c(n1CCN1CCOCC1)c(=O)n(c(=O)n2C)C

STK593346
Synonyms: N'-[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl]-N,N-diethylpropane-1,3-diamine
Smiles: CCN(CCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C)CC

STK593348
Synonyms: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK593349
Synonyms: N-(4-chlorophenyl)-1-(4-ethoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)Cl)n2c3c1CCCCn3c(c2)c1ccc(cc1)C

STK593350
Synonyms: 4,5-dimethoxy-N'-[(E)-(2-methoxyphenyl)methylidene]-1H-indole-2-carbohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)c1cc2c([nH]1)ccc(c2OC)OC

STK593351
Synonyms: (1'R,2'S)-1'-acetyl-2'-(2,4-dichlorophenyl)-7'-methyl-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Cc1ccc2c(c1)C=CC1N2[C@@H](C(=O)C)[C@@H]([C@@]21C(=O)c1c(C2=O)cccc1)c1ccc(cc1Cl)Cl

STK593352
Synonyms: (1'S,2'S,3R,3a'R)-2'-[(4-fluorophenyl)carbonyl]-7'-methyl-1'-(phenylcarbonyl)-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)c2ccccc2)N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)C

STK593353
Synonyms: N-(3-chloro-2-methylphenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)Nc2cccc(c2C)Cl)c2c(n1)c1ccccc1o2

STK593354
Synonyms: (4E)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-ethoxy-4-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccc(cc1Cl)Cl

STK593355
Synonyms: N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-5-(4-methoxybenzyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: COc1ccc(cc1)CN1CNC(=NC1)/N=c/1\sc2c([nH]1)cccc2

STK593356
Synonyms: 2-{[5-(2-fluorophenyl)-4-(4-methoxyphenyl)-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)nnc1c1ccccc1F

STK593357
Synonyms: (2S)-N-(2,4-difluorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: O=C([C@@H](n1c(O)nc2c(c1=O)cccc2)C)Nc1ccc(cc1F)F

STK593358
Synonyms: (5E)-6-hydroxy-3-(2-methylphenyl)-5-[1-(piperidin-1-ylamino)ethylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C(\NN2CCCCC2)/C)/C(=O)N1c1ccccc1C

STK593359
Synonyms: 5-{[(3-ethyl-2',6'-dihydroxy-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCN1CCN2C(C1)C1(Cc3c2ccc(c3)NC=C2C(=O)N(C)C(=O)N(C2=O)C)C(=NC(=NC1=O)O)O

STK593360
Synonyms: N,1,4-triphenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: O=C(c1n2cc(n3c2c(c1c1ccccc1)CCCC3)c1ccccc1)Nc1ccccc1

STK593361
Synonyms: methyl4-{[(3Z)-1-ethyl-8-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]amino}-4-oxobutanoate
Smiles: COC(=O)CCC(=O)/N=c/1\[nH]n(c2c1cc1cccc(c1n2)C)CC

STK593364
Synonyms: 2-chloro-7-(4-methoxyphenyl)-6-[4-(methylsulfanyl)phenyl]-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1)C1C2=C(Nc3n1ncn3)c1c(OC2c2ccc(cc2)SC)ccc(c1)Cl

STK593365
Synonyms: 9-(2-methoxyphenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccccc1C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1

STK593370
Synonyms: N-[(2E)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: CCCc1n[nH]/c(=N\C(=O)c2ccccc2)/s1

STK593372
Synonyms: N-(4-ethylphenyl)-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1cccc(c1)C

STK593374
Synonyms: 8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cccc(c1)N1CCN(CC1)Cc1nc2c(n1CCCc1ccccc1)c(=O)n(c(=O)n2C)C

STK593375
Synonyms: 2-{[4-(4-methylphenyl)-5-(pyridin-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)c1ccccn1

STK593376
Synonyms: 2-[5-(3,4-dichlorophenyl)furan-2-yl]-4-imino-6,7,11,12-tetrahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc2OCCCOc2c1)c1ccc(o1)c1ccc(c(c1)Cl)Cl

STK593378
Synonyms: N-[7-(4-chlorophenyl)-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-4-methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1[nH]c2=NC(=CC(n2n1)c1ccc(cc1)Cl)c1ccccc1

STK593379
Synonyms: ethyl4-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(c2ccc(cc2)OC)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STK593382
Synonyms: methyl4-[({[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)OC)nnc1c1cccc(c1)Cl

STK593383
Synonyms: (2E)-3-[(4-ethoxyphenyl)amino]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: CCOc1ccc(cc1)N/C=C(/c1nc2c(n1C)cccc2)\C#N

STK593384
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,4-difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK593385
Synonyms: 8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-ylN-[(benzyloxy)carbonyl]-D-methioninate
Smiles: CSCC[C@H](C(=O)Oc1cc2oc(=O)c3c(c2cc1Cl)CCC3)NC(=O)OCc1ccccc1

STK593386
Synonyms: 2-{[4-amino-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Smiles: CC(c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1cc([nH]n1)c1ccccc1)C

STK593387
Synonyms: 8-methyl-N-(tetrahydrofuran-2-ylmethyl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-amine
Smiles: CN1CCc2c(C1)sc1c2c(NCC2CCCO2)nc2n1nnn2

STK593391
Synonyms: 4-(4-chlorophenyl)-3-[(4-methylphenoxy)methyl]-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Smiles: Clc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1COc1ccc(cc1)C

STK593392
Synonyms: N-benzyl-2-[(11-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]acetamide
Smiles: CC1CCc2c(C1)sc1c2c2ncnn2c2n1c(SCC(=O)NCc1ccccc1)nn2

STK593393
Synonyms: 7-chloro-1-(3-ethoxyphenyl)-2-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cccc(c1)C1N(c2ccccn2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK593394
Synonyms: 1-(3-chlorophenyl)-2-(6-methylpyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1cccc(c1)C1N(c2cccc(n2)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593395
Synonyms: N'-[(E)-quinolin-6-ylmethylidene]pyridine-4-carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1ccc2c(c1)cccn2

STK593397
Synonyms: N-(2-methoxyethyl)-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: COCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2

STK593398
Synonyms: (4Z)-6-(1-benzofuran-2-yl)-4-[(3-methylphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Cc1cccc(c1)/N=c/1\nc(N)nc([nH]1)c1cc2c(o1)cccc2

STK593400
Synonyms: 4-(4-chlorophenyl)-1-(4-ethylphenyl)-N-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccc(cc1)C)cc3c1ccc(cc1)Cl

STK593401
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC

STK593402
Synonyms: 3-[(2-chlorobenzyl)oxy]-1-hydroxy-5-methyl-9H-xanthen-9-one
Smiles: Clc1ccccc1COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK593403
Synonyms: 3-benzyl-2-(4-fluorophenyl)-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: Fc1ccc(cc1)c1nc2sc3ccccc3c(=O)c2c(=O)n1Cc1ccccc1

STK593408
Synonyms: 4-[({[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1COc1ccccc1

STK593411
Synonyms: 5-(3-chlorophenyl)-4-{[(E)-(2,6-dichlorophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c(Cl)cccc1Cl

STK593412
Synonyms: N-[4-(diethylamino)phenyl]-2-{[5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1CC=C)c1ccc(cc1)F)CC

STK593413
Synonyms: ethyl4-[(3a'S,6a'R)-3'-(1H-indol-3-ylmethyl)-7-methyl-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]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2C

STK593415
Synonyms: N-(3-bromophenyl)-2-({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1cccc(c1)Br)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)C

STK593417
Synonyms: (4Z)-2-(2-chlorophenyl)-4-[2-(3,4-dimethoxyphenyl)-4H-chromen-4-ylidene]-1,3-oxazol-5(4H)-one
Smiles: COc1cc(ccc1OC)C1=C/C(=C\2/N=C(OC2=O)c2ccccc2Cl)/c2c(O1)cccc2

STK593418
Synonyms: (2Z)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-(4-methyl-3-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(c(c1)[N+](=O)[O-])C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK593420
Synonyms: 7-fluoro-2-(5-methyl-1,2-oxazol-3-yl)-1-(3,4,5-trimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(cc(c1OC)OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK593421
Synonyms: 3-(3-chlorophenyl)-7-methyl-2-[(tetrahydrofuran-2-ylmethyl)amino]-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)NCC1CCCO1)c1cccc(c1)Cl

STK593422
Synonyms: 1-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-3-methyl-1,3-dihydro-2H-benzimidazole-2-thione
Smiles: Cn1c(=S)n(c2c1cccc2)/N=C/c1ccc2c(c1)OCO2

STK593423
Synonyms: 2-(4-chlorophenyl)-N-[(2E)-5,5-dioxido-3-phenyltetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccccc1)CS(=O)(=O)C2)Cc1ccc(cc1)Cl

STK593424
Synonyms: 2-methyl-N-[3-oxo-2-(trifluoromethyl)-2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-2-yl]benzamide
Smiles: O=C(c1ccccc1C)NC1(Nc2n(C1=O)c1c(n2)cccc1)C(F)(F)F

STK593425
Synonyms: 4-({(2'S,3S,3'S,10b'R)-2'-[(3,4-dimethoxyphenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl}carbonyl)phenylacetate
Smiles: COc1cc(ccc1OC)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC(=O)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK593426
Synonyms: N-(2-chlorophenyl)-4-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1nnc2c(c1=O)cccc2)Nc1ccccc1Cl

STK593427
Synonyms: 2-[(2-fluorophenyl)sulfonyl]-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2c(cc1OC)CCN(C2C)S(=O)(=O)c1ccccc1F

STK593428
Synonyms: 3-methoxy-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylpropyl)benzamide
Smiles: COc1cccc(c1)C(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)CC(C)C

STK593429
Synonyms: N-(2-bromophenyl)-2-{[5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2ccccc2Br)nnc1c1cccc(c1)Cl

STK593430
Synonyms: 7-methyl-8-{[2-(trifluoromethyl)phenyl]sulfonyl}-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: CC1c2cc3OCCCOc3cc2CCN1S(=O)(=O)c1ccccc1C(F)(F)F

STK593432
Synonyms: 4-chloro-N-[1-methyl-4-oxo-3-(3,4,5-trimethoxyphenyl)-1,4-dihydroquinolin-2-yl]benzamide
Smiles: COc1cc(cc(c1OC)OC)c1c(NC(=O)c2ccc(cc2)Cl)n(C)c2c(c1=O)cccc2

STK593433
Synonyms: N-(3-chloro-2-methylphenyl)-2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2C)Cl)nnc1c1cccc(c1)Cl

STK593435
Synonyms: 2-[(3a'S,6a'R)-5'-butyl-5-fluoro-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(F)cc2

STK593436
Synonyms: N'-[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl]-N,N-dimethylpropane-1,3-diamine
Smiles: CC(Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCCCN(C)C)C

STK593438
Synonyms: 3'-tert-butyl-7-chloro-3-ethyl-6'-hydroxy-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: CCN1CCN2C(C1)C1(Cc3c2cccc3Cl)C(=NC(=O)N(C1=O)C(C)(C)C)O

STK593439
Synonyms: 2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(propan-2-yl)acetamide
Smiles: CC(NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)F)C

STK593440
Synonyms: 3-(2,5-dimethylbenzyl)-8-(4-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cc(C)ccc1C

STK593441
Synonyms: (3R,3'S,3a'S,6a'R)-5'-(5-chloro-2-methoxyphenyl)-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: CSCC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1cc(Cl)ccc1OC)C(=O)Nc1c2cccc1

STK593444
Synonyms: 3-[(3,4-dichlorobenzyl)sulfanyl]-5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(c(c2)Cl)Cl)nnc1c1cccc(c1)C

STK593445
Synonyms: 2-(3,4-dimethoxyphenyl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1

STK593446
Synonyms: (E)-[2-(3,4-dichlorophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene][4-(propan-2-yloxy)phenyl]methanolate
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)Cc1ccc[nH+]c1)/[O-])C

STK593448
Synonyms: 4-{[(E)-(2,3-dichlorophenyl)methylidene]amino}-5-(2-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1c(cccc1Cl)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK593449
Synonyms: 3-(3-chlorophenyl)-4-(4-chlorophenyl)-5-[(3,4-dimethylbenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: Clc1ccc(cc1)n1c(SCc2ccc(c(c2)C)C)nnc1c1cccc(c1)Cl

STK593450
Synonyms: N-(furan-2-ylmethyl)-8-methyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-amine
Smiles: CN1CCc2c(C1)sc1c2c(NCc2ccco2)nc2n1nnn2

STK593452
Synonyms: N-{(1Z)-1-[1-cyano-2-(cyclopentylamino)-2-oxoethylidene]-1H-isoindol-3-yl}-3,4,5-trimethoxybenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cc(OC)c(c(c1)OC)OC)/C(=O)NC1CCCC1

STK593453
Synonyms: N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]-5-[2-(naphthalen-1-ylmethoxy)phenyl]-1H-pyrazole-3-carbohydrazide
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)c1n[nH]c(c1)c1ccccc1OCc1cccc2c1cccc2)O

STK593454
Synonyms: N-[3-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-L-leucyl-S-benzyl-L-cysteine
Smiles: CC(C[C@@H](C(=O)N[C@H](C(=O)O)CSCc1ccccc1)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)C

STK593455
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(3-nitrophenyl)carbonyl]-2'-{[4-(prop-2-en-1-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: C=CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccc(c2)[N+](=O)[O-])N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK593456
Synonyms: N-(4-methoxybenzyl)-2-(5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)acetamide
Smiles: COc1ccc(cc1)CNC(=O)Cn1c2ccccc2c2c1c(=O)n1CCSc1n2

STK593457
Synonyms: N,4-dimethyl-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)C

STK593459
Synonyms: 6-(2-methylphenyl)-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Cc1ccccc1C1CC(=C2C(=Nc3n(C2c2ccccc2)ncn3)C1)O

STK593462
Synonyms: 5-(3-chlorophenyl)-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)Cl

STK593465
Synonyms: 8-{[2-(diethylamino)ethyl]amino}-6-hydroxy-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCN(CCNc1nc2c(n1CC(COc1cccc(c1)C)O)c(O)nc(=O)n2C)CC

STK593466
Synonyms: 8-(4-fluorophenyl)-1-methyl-3-(3-methylbutyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CC(CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)F)C

STK593469
Synonyms: 3-(4-methoxybenzyl)-10-methyl-2-pentylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCCCc1nc2c(c(=O)n1Cc1ccc(cc1)OC)c(=O)c1c(n2C)cccc1

STK593471
Synonyms: 1-[3-amino-6-(1,3-benzodioxol-5-yl)thieno[2,3-b]pyridin-2-yl]ethanone
Smiles: CC(=O)c1sc2c(c1N)ccc(n2)c1ccc2c(c1)OCO2

STK593474
Synonyms: 2-(10-fluoro-6-oxo-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-7(6H)-yl)acetamide
Smiles: NC(=O)Cn1c2ccc(cc2c2c1c(=O)n1CCCSc1n2)F

STK593475
Synonyms: 2,2-dimethyl-N-[2-(morpholin-4-yl)ethyl]-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCCN1CCOCC1

STK593477
Synonyms: {4-[(3aR,4R,4aR,7aS,8R,8aR)-6-(1,3-benzodioxol-5-yl)-5,7-dioxo-4,4a,5,6,7,7a,8,8a-octahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindol-3-yl]phenoxy}acetonitrile
Smiles: N#CCOc1ccc(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)c1ccc2c(c1)OCO2

STK593478
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-bromo-2-fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1F)Br)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK593479
Synonyms: (E)-{1'-[2-(dimethylammonio)ethyl]-2,4',5'-trioxo-1-(prop-2-en-1-yl)-1,2-dihydro-3'H-spiro[indole-3,2'-pyrrolidin]-3'-ylidene}(4-propoxyphenyl)methanolate
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C21C(=O)N(c1c2cccc1)CC=C)CC[NH+](C)C)/[O-]

STK593480
Synonyms: 8-[4-(4-chlorobenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-(2-methylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: Clc1ccc(cc1)CN1CCN(CC1)c1nc2c(n1CC(C)C)c(O)nc(=O)n2C

STK593481
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(4-nitrophenyl)-1-phenylpyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)[N+](=O)[O-])N(C(=O)C1=O)c1ccccc1)/O

STK593482
Synonyms: N-[1-(3,4-dimethylphenyl)-4-hydroxy-2,6-dioxo-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-3-methoxybenzamide
Smiles: COc1cccc(c1)C(=O)NC1(C(=O)Nc2c1c(O)nc(=O)n2c1ccc(c(c1)C)C)C(F)(F)F

STK593483
Synonyms: 2-{5-[(4-methoxybenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}pyridine
Smiles: COc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK593484
Synonyms: 1,3,7,7-tetramethyl-5,10-diphenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: O=c1n(C)c(=O)c2c(n1C)c1C(OCC(n1c2c1ccccc1)(C)C)c1ccccc1

STK593485
Synonyms: 7-chloro-6-methyl-1-(3-nitrophenyl)-2-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: O=C1N(c2ccccn2)C(c2c1oc1cc(C)c(cc1c2=O)Cl)c1cccc(c1)[N+](=O)[O-]

STK593486
Synonyms: 4-({(E)-[3-(benzyloxy)phenyl]methylidene}amino)-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1cccc(c1)OCc1ccccc1

STK593487
Synonyms: 4-(9-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)sc1c2c2nc(nn2cn1)c1ccc(cc1)O

STK593488
Synonyms: 1-(4-chlorophenyl)-N-(3-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Clc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)C)cc3c1ccccc1

STK593489
Synonyms: 2-chloro-N-{(1Z)-1-[1-cyano-2-(cyclopentylamino)-2-oxoethylidene]-1H-isoindol-3-yl}benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1Cl)/C(=O)NC1CCCC1

STK593490
Synonyms: 5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CN1C(=O)N(C)C(=O)C(=Cc2ccc3c(c2)CCN3Cc2ccccc2Cl)C1=O

STK593491
Synonyms: 10-(3-methoxyphenyl)-5-(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(cc1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1cccc(c1)OC

STK593492
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)cccc1

STK593493
Synonyms: 7-chloro-1-(2-methoxyphenyl)-6-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccccc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK593494
Synonyms: 2,12,12-trimethyl-7-[(2-phenylethyl)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: Cc1nn2c(n1)c1c3CC(C)(C)OCc3sc1n1c2nnc1SCCc1ccccc1

STK593495
Synonyms: N-(2,5-dimethylphenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1

STK593496
Synonyms: 1-(4-methoxyphenyl)-5-oxo-N-{(2S)-1-oxo-1-[(2-phenylethyl)amino]propan-2-yl}pyrrolidine-3-carboxamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)NCCc1ccccc1)C

STK593497
Synonyms: 4-[({[4-(4-chlorophenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK593499
Synonyms: 4-bromo-N'-[(E)-(5-methoxy-1H-indol-3-yl)methylidene]benzohydrazide
Smiles: COc1ccc2c(c1)c(/C=N/NC(=O)c1ccc(cc1)Br)c[nH]2

STK593501
Synonyms: 6-amino-1-(4-chlorophenyl)-4-(4-hydroxy-3-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(c(c1)OC)O)c(C)nn2c1ccc(cc1)Cl

STK593502
Synonyms: 8-(benzylamino)-6-hydroxy-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-2H-purin-2-one
Smiles: Cc1cccc(c1)Cn1c(NCc2ccccc2)nc2c1c(O)nc(=O)n2C

STK593503
Synonyms: N-[5-hydroxy-2-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]cyclohexanecarboxamide
Smiles: COc1ccc(cc1)c1nn2c(n1)nc(cc2NC(=O)C1CCCCC1)O

STK593504
Synonyms: 6-chloro-2-oxo-4-propyl-2H-chromen-7-yl2-{[(benzyloxy)carbonyl]amino}butanoate
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)C(NC(=O)OCc1ccccc1)CC

STK593505
Synonyms: 5-(2,4-dichlorophenyl)-4-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccc(c(c1)Cl)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)C

STK593507
Synonyms: 3-(2-phenylethyl)-1-[2-(piperidin-1-yl)ethyl]-1,5,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: O=c1n(CCc2ccccc2)c(=O)c2c(n1CCN1CCCCC1)sc1c2CCCCC1

STK593508
Synonyms: (5E)-6-hydroxy-3-(2-methylphenyl)-5-({[2-(pyridin-3-yl)piperidin-1-yl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/NN1CCCCC1c1cccnc1)c1ccccc1C

STK593509
Synonyms: 4-[7-(2-chlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Smiles: Oc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1ccccc1Cl

STK593511
Synonyms: 4-{[(E)-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]amino}-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1nn(c(c1/C=N/n1c(=S)[nH]nc1c1ccccc1)C)c1ccccc1

STK593512
Synonyms: (E)-N-[(10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]-1-phenylmethanimine
Smiles: CC1(C)OCc2c(C1)c1c(s2)ncn2c1nc(n2)CO/N=C/c1ccccc1

STK593513
Synonyms: 4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl{[(benzyloxy)carbonyl]amino}(phenyl)acetate
Smiles: O=C(NC(C(=O)Oc1ccc2c(c1)oc(=O)c1c2CCC1)c1ccccc1)OCc1ccccc1

STK593514
Synonyms: 2-(4-benzylpiperazin-1-yl)-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4-ol
Smiles: Oc1cc(CSc2nnnn2c2ccccc2)nc(n1)N1CCN(CC1)Cc1ccccc1

STK593516
Synonyms: 2-[(6-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-4-ylmethyl)acetamide
Smiles: O=C(COc1cc2oc(=O)cc(c2cc1Cl)C)NCc1ccncc1

STK593517
Synonyms: (3R)-N-[2-(4-chlorophenyl)ethyl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: Clc1ccc(cc1)CCNC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

STK593520
Synonyms: 3-benzyl-2-[(pyridin-3-ylmethyl)amino]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: O=c1c2c(sc3c2CCCCC3)nc(n1Cc1ccccc1)NCc1cccnc1

STK593521
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-5-hydroxy-4-(4-methylphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(SCc2ccc(cc2)Cl)N=C2C(=C(O)CCC2)C1c1ccc(cc1)C

STK593523
Synonyms: 4-{[(E)-anthracen-9-ylmethylidene]amino}-5-(2-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1c2ccccc2cc2c1cccc2

STK593524
Synonyms: 1-ethyl-5-methoxy-2-methyl-N-(pyridin-2-ylmethyl)-1H-indole-3-carboxamide
Smiles: COc1ccc2c(c1)c(C(=O)NCc1ccccn1)c(n2CC)C

STK593525
Synonyms: 1-[5-chloro-4-(methylamino)-6-oxopyridazin-1(6H)-yl]tricyclo[3.3.1.1~3,7~]decane-2-carboxylicacid
Smiles: CNc1cnn(c(=O)c1Cl)C12CC3CC(C1)CC(C2C(=O)O)C3

STK593526
Synonyms: (4E)-1-(5-bromopyridin-2-yl)-4-[hydroxy(phenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Brc1ccc(nc1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)[N+](=O)[O-]

STK593528
Synonyms: (2,6-difluorophenyl)(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1c(F)cccc1F

STK593529
Synonyms: ethyl[3-(2-methoxyphenyl)-1',3'-dimethyl-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl]carbamate
Smiles: CCOC(=O)Nc1ccc2c(c1)CC1(C3N2CCN(C3)c2ccccc2OC)C(=O)N(C)C(=O)N(C1=O)C

STK593530
Synonyms: 2-[(4-benzylpiperidin-1-yl)carbonyl]-1-(3-methoxypropyl)-9-methylpyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)N1CCC(CC1)Cc1ccccc1

STK593531
Synonyms: N-(3,5-dimethylphenyl)-2-(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CN1CCc2c(C1C)cc1c(c2)OCCCO1

STK593532
Synonyms: (3a'S,6a'R)-5'-(butan-2-yl)-3'-(2-methylpropyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1cccc2)C

STK593534
Synonyms: 2-[(2-fluorobenzyl)sulfanyl]-6,6-dimethyl-3-(4-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Cc1ccc(cc1)n1c(SCc2ccccc2F)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK593537
Synonyms: 7'-{[(E)-(1-tert-butyl-2-hydroxy-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]amino}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trio
Smiles: O=C1N=C(O)N(C(=O)/C/1=C/Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)C(C)(C)C