Home » FULL DB

FULL DB

Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )

Direct access:

Prev 920 921 922 923 924 925 926 927 928 929 Next

STK612270
Synonyms: 5-[(4-ethenylbenzyl)oxy]-2-[5-(2-ethoxyphenoxy)pyrimidin-4-yl]phenol
Smiles: CCOc1ccccc1Oc1cncnc1c1ccc(cc1O)OCc1ccc(cc1)C=C

STK855168
Synonyms: 5-{4-[(3-chlorophenyl)carbonyl]piperazin-1-yl}-2-(thiophen-2-yl)-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1cccc(c1)Cl)c1cccs1

STK612276
Synonyms: N'-[5,6-dimethyl-7-(2-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-N,N-dimethylpropane-1,3-diamine
Smiles: CN(CCCNc1ncnc2c1c(C)c(n2CCc1ccccc1)C)C

STK612277
Synonyms: 3-(3,4-dimethoxyphenyl)-4-methyl-7-[2-(piperidin-1-yl)ethoxy]-2H-chromen-2-one
Smiles: COc1cc(ccc1OC)c1c(=O)oc2c(c1C)ccc(c2)OCCN1CCCCC1

STK612278
Synonyms: 3-(3,4-dimethoxyphenyl)-7-[2-(4-phenylpiperazin-1-yl)ethoxy]-4H-chromen-4-one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc(c2)OCCN1CCN(CC1)c1ccccc1

STK612284
Synonyms: 6-chloro-7-hydroxy-4-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-2H-chromen-2-one
Smiles: CN1CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl

STK612286
Synonyms: 5-methyl-6-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-3-phenyl-7H-furo[3,2-g]chromen-7-one
Smiles: CN1CCN(CC1)C(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1

STK855172
Synonyms: 2-(3-methoxyphenyl)-5-{4-[(2-methoxyphenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: COc1cccc(c1)c1nc(c(o1)N1CCN(CC1)C(=O)c1ccccc1OC)C#N

STK612290
Synonyms: (2S)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Smiles: O=C([C@@H](n1nnc2c(c1=O)cccc2)C)Nc1cc(ccc1Cl)C(F)(F)F

STK855173
Synonyms: 5-chloro-2-[(4-fluorobenzyl)sulfanyl]-N-(4-fluorophenyl)pyrimidine-4-carboxamide
Smiles: Fc1ccc(cc1)CSc1ncc(c(n1)C(=O)Nc1ccc(cc1)F)Cl

STK612296
Synonyms: 2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]-N-(pyridin-3-ylmethyl)acetamide
Smiles: CCCc1cc(=O)oc2c1c(OCC(=O)NCc1cccnc1)cc(c2)C

STK612297
Synonyms: 6-{(E)-2-[4-(methylsulfanyl)phenyl]ethenyl}-5-nitropyrimidine-2,4-diol
Smiles: CSc1ccc(cc1)/C=C/c1nc(O)nc(c1[N+](=O)[O-])O

STK612299
Synonyms: 5-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-7-(3-methoxyphenyl)-6,7-dihydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: COc1cccc(c1)C1CC(=Nc2n1ncc2C(=O)N)c1c(O)cc(oc1=O)C

STK612303
Synonyms: (2E)-3-(1,3-benzodioxol-5-yl)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]prop-2-enamide
Smiles: O=C(N[C@H](c1nnc2n1cccc2)C)/C=C/c1ccc2c(c1)OCO2

STK612304
Synonyms: 7-(furan-2-ylmethyl)-5,6-dimethyl-3-[2-(morpholin-4-yl)ethyl]-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1c(C)n(c2c1c(=N)n(CCN1CCOCC1)cn2)Cc1ccco1

STK612312
Synonyms: N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)-3-[(5Z)-5-(4-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]propanamide
Smiles: COc1ccc(cc1)/C=C/1\SC(=O)N(C1=O)CCC(=O)NC1C=CS(=O)(=O)C1

STK612314
Synonyms: methylN-({[3-(furan-2-ylmethyl)-7-hydroxy-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetyl)glycinate
Smiles: COC(=O)CNC(=O)CSc1nc(O)c2c(n1)n(Cc1ccco1)c(=S)s2

STK855175
Synonyms: (2Z)-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl1,3-benzodioxole-5-carboxylate
Smiles: Cc1cc(cc2c1C(=O)/C(=C/c1cccnc1)/O2)OC(=O)c1ccc2c(c1)OCO2

STK612316
Synonyms: {1-[2-(dimethylamino)ethyl]-7-methyl-2,4-dioxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl}aceticacid
Smiles: CN(CCn1c2sc3c(c2c(=O)n(c1=O)CC(=O)O)CCC(C3)C)C

STK612317
Synonyms: 3-[2-(4-hydroxyphenyl)ethyl]-2-methylquinazolin-4(3H)-one
Smiles: Oc1ccc(cc1)CCn1c(C)nc2c(c1=O)cccc2

STK855176
Synonyms: 2-(4-chlorophenyl)-5-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1cccs1)c1ccc(cc1)Cl

STK612318
Synonyms: 2-hydroxy-5-methyl-4-oxo-3-(pyridin-4-ylmethyl)-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylicacid
Smiles: OC(=O)c1sc2c(c1C)c(=O)n(c(n2)O)Cc1ccncc1

STK612319
Synonyms: N-(4-{(3Z)-3-[(1-methyl-1H-indol-3-yl)methylidene]-2,5-dioxopyrrolidin-1-yl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)C/C(=C/c2cn(c3c2cccc3)C)/C1=O

STK612326
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(5-methyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1)NC1CCS(=O)(=O)C1

STK612333
Synonyms: 2-methyl-4-[2-(naphthalen-2-yl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CC1Oc2ccccc2C(=O)N(C1=O)CC(=O)c1ccc2c(c1)cccc2

STK612335
Synonyms: N-{1-[(furan-2-ylmethyl)amino]-3-methyl-1-oxopentan-2-yl}-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: CCC(C(C(=O)NCc1ccco1)NC(=O)N1CC(=Nc2c1cccc2)O)C

STK612336
Synonyms: 5-bromo-N-(3-{[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]amino}-3-oxopropyl)furan-2-carboxamide
Smiles: O=C(NCc1cc(=O)n(c(=O)n1C)C)CCNC(=O)c1ccc(o1)Br

STK612343
Synonyms: 1-(2,3-dimethylphenyl)-2-hydroxy-6-(pyridin-3-ylmethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Oc1nc(=O)c2c(n1c1cccc(c1C)C)NCN(C2)Cc1cccnc1

STK855181
Synonyms: 2-(2-fluorophenyl)-5-{4-[(4-fluorophenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccc(cc1)F)c1ccccc1F

STK612352
Synonyms: 2-(3,4-dimethoxybenzyl)-7-(4-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccc(cc1)n1c2ncn3c(c2c(c1C)C)nc(n3)Cc1ccc(c(c1)OC)OC

STK855182
Synonyms: 2-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1-(morpholin-4-yl)ethanone
Smiles: O=C(N1CCOCC1)Cc1nn2c(n1)nc(c(c2C)Cl)C

STK612357
Synonyms: 2-[(4-chlorophenoxy)methyl]-8,9-dimethyl-7-(pyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1ccccn1

STK612358
Synonyms: 1-(4-chlorophenyl)-3-[(2Z)-5-(1-phenylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: CCC(c1n[nH]/c(=N/C(=O)Nc2ccc(cc2)Cl)/s1)c1ccccc1

STK612359
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-N'-(furan-2-ylmethyl)ethanediamide
Smiles: N#Cc1c(NC(=O)C(=O)NCc2ccco2)sc2c1CCC2

STK612360
Synonyms: N-benzyl-6-chloro-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: O=C(c1nn2c(n1)nc(c(c2O)Cl)C)NCc1ccccc1

STK612362
Synonyms: 6-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]-2-methyl-3-[2-(4-phenylpiperazin-1-yl)ethoxy]phenol
Smiles: COc1ccc(cc1)c1cn[nH]c1c1ccc(c(c1O)C)OCCN1CCN(CC1)c1ccccc1

STK612363
Synonyms: 6-methoxy-3-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazine
Smiles: COc1ccc(cc1)c1nnc2n1nc(OC)cc2

STK855184
Synonyms: 4-ethyl-N-[3-(ethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,2,3-thiadiazole-5-carboxamide
Smiles: CCNC(=O)c1c(NC(=O)c2snnc2CC)sc2c1CCCC2

STK612368
Synonyms: 5-[(4-chlorobenzyl)oxy]-2-[4-(4-chlorophenyl)-1H-pyrazol-5-yl]phenol
Smiles: Clc1ccc(cc1)COc1ccc(c(c1)O)c1[nH]ncc1c1ccc(cc1)Cl

STK855185
Synonyms: 2-[2-amino-5-(3-methoxyphenoxy)pyrimidin-4-yl]-5-[(3-chlorobenzyl)oxy]phenol
Smiles: COc1cccc(c1)Oc1cnc(nc1c1ccc(cc1O)OCc1cccc(c1)Cl)N

STK612371
Synonyms: 1-[2-(4-bromophenyl)-2-oxoethyl]-4-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
Smiles: Brc1ccc(cc1)C(=O)CN1C(=O)CN(C(=O)c2c1cccc2)C

STK612372
Synonyms: 5-(4-ethoxy-3-methoxyphenyl)-4-hydroxy-2-methyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: CCOc1ccc(cc1OC)C1CC(=O)Nc2c1c(O)nc(n2)C

STK612373
Synonyms: N-(pyridin-4-ylmethyl)-2-[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]propanamide
Smiles: CC(C(=O)NCc1ccncc1)Oc1ccc2c(c1C)oc(=O)c(c2C)C

STK612376
Synonyms:
Smiles: CSCC[C@@H](C(=O)N[C@@H](C(CC)C)C(=O)O)NC(=O)N1CCn2c1nc1c2cccc1

STK612377
Synonyms: 1'-(azepan-1-ylcarbonyl)-3'H-spiro[cyclopentane-1,5'-pyrrolo[2,1-a]isoquinoline]-2',3'(6'H)-dione
Smiles: O=C(C1=C2c3ccccc3CC3(N2C(=O)C1=O)CCCC3)N1CCCCCC1

STK612379
Synonyms: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(2-methoxyphenyl)-6-methylpyrimidin-4-amine
Smiles: COc1ccccc1Nc1nc(nc(c1Br)C)n1nc(cc1C)C

STK612381
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(NC1CCS(=O)(=O)C1)COc1cc(O)c2c(c1)OC(CC2=O)(C)C

STK855186
Synonyms: (6-butyl-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)(morpholin-4-yl)methanone
Smiles: CCCCc1c(C)nc2n(c1O)nc(n2)C(=O)N1CCOCC1

STK855187
Synonyms: N-(4-{[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]methoxy}phenyl)-N-methylacetamide
Smiles: Cc1ccc(c(c1)C)n1nnnc1COc1ccc(cc1)N(C(=O)C)C

STK612388
Synonyms: 2-{6-chloro-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
Smiles: CC(=C)COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)Nc1ccc(cc1)CN1CCOCC1

STK855188
Synonyms: 2-[(2-methoxyphenyl)amino]-8-methyl-4-(pyridin-3-yl)-4,9-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Smiles: COc1ccccc1NC1=NC(n2c(=N1)[nH]c(C)cc2=O)c1cccnc1

STK612390
Synonyms: 2-[3-(1H-imidazol-1-yl)propyl]-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: O=C1N(CCCn2cncc2)C(c2c1oc1ccccc1c2=O)c1ccccc1

STK612391
Synonyms: ethyl1-[(6-methyl-2-oxo-2H-chromen-4-yl)methyl]piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)Cc1cc(=O)oc2c1cc(C)cc2

STK612394
Synonyms: 5-(benzyloxy)-2-[4-(2-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]phenol
Smiles: COc1ccccc1c1c([nH]nc1C(F)(F)F)c1ccc(cc1O)OCc1ccccc1

STK612397
Synonyms: 1-benzyl-N-(pyridin-3-ylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Smiles: c1ccc(cc1)Cn1ncc2c1ncnc2NCc1cccnc1

STK612400
Synonyms: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2C)O)NCCc1c[nH]c2c1cc(Cl)cc2

STK612401
Synonyms: 1-(4-methoxyphenyl)-4-oxo-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]-1,4-dihydropyridazine-3-carboxamide
Smiles: COc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1

STK855190
Synonyms: 1,3-dimethyl-7-[(naphthalen-2-yloxy)methyl]-6,7-dihydro[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n1CC(Oc1n2)COc1ccc2c(c1)cccc2

STK612404
Synonyms: 4-{[2-(morpholin-4-ylsulfonyl)ethyl](pyridin-3-ylmethyl)amino}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N(Cc1cccnc1)CCS(=O)(=O)N1CCOCC1

STK855192
Synonyms: (2Z)-2-(3,4-dimethoxybenzylidene)-4-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yldimethylcarbamate
Smiles: COc1cc(ccc1OC)/C=C/1\Oc2c(C1=O)c(C)cc(c2)OC(=O)N(C)C

STK612408
Synonyms: N-benzyl-N'-(quinolin-5-yl)ethanediamide
Smiles: O=C(C(=O)NCc1ccccc1)Nc1cccc2c1cccn2

STK612409
Synonyms: 5-hydroxy-4b,6,7,8-tetrahydro-15H-dibenzo[2,3:5,6][1,4]diazepino[7,1-a]isoindol-15-one
Smiles: OC1=C2C(=Nc3c(N4C2c2ccccc2C4=O)cccc3)CCC1

STK612413
Synonyms: ethyl{1-[3-(dimethylamino)propyl]-7-methyl-2,4-dioxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl}acetate
Smiles: CCOC(=O)Cn1c(=O)c2c3CCC(Cc3sc2n(c1=O)CCCN(C)C)C

STK855194
Synonyms: 7-[2-(2,6-dimethylmorpholin-4-yl)ethoxy]-3-(4-methoxyphenyl)-2-methyl-4H-chromen-4-one
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCCN1CC(C)OC(C1)C

STK612415
Synonyms: 1-[5-bromo-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4-yl]azepane
Smiles: Cc1nn(c(c1)C)c1nc(N2CCCCCC2)c(c(n1)C)Br

STK612419
Synonyms: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-6-(4-methylpiperazin-1-yl)pyrimidine
Smiles: CN1CCN(CC1)c1nc(nc(c1Br)C)n1nc(cc1C)C

STK612421
Synonyms: 4-[2-(3-nitrophenyl)-2-oxoethyl]-2-(propan-2-yl)-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CN1C(=O)C(Oc2c(C1=O)cccc2)C(C)C

STK612422
Synonyms: (7-hydroxy-5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)(morpholin-4-yl)methanone
Smiles: O=C(c1nc2n(n1)c(O)c(c(n2)C)C)N1CCOCC1

STK612426
Synonyms: N-{[4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl]methyl}-N'-(2-phenylethyl)ethanediamide
Smiles: COc1ccc(cc1)C1(CCOCC1)CNC(=O)C(=O)NCCc1ccccc1

STK855197
Synonyms: 5-chloroquinolin-8-yl3,4-dimethoxybenzenesulfonate
Smiles: COc1cc(ccc1OC)S(=O)(=O)Oc1ccc(c2c1nccc2)Cl

STK612430
Synonyms: 2-{[(benzylamino)(oxo)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylicacid
Smiles: O=C(C(=O)NCc1ccccc1)Nc1sc2c(c1C(=O)O)CCC2

STK612431
Synonyms: 3-[(5-chloro-2-hydroxyphenyl)amino]-6-methyl-1,2,4-triazin-5-ol
Smiles: Clc1ccc(c(c1)Nc1nnc(c(n1)O)C)O

STK612434
Synonyms: 1-[4-(2-chlorophenyl)-3-(4-chlorophenyl)butyl]pyrrolidine
Smiles: Clc1ccc(cc1)C(Cc1ccccc1Cl)CCN1CCCC1

STK612437
Synonyms: 7-(furan-2-ylmethyl)-8,9-dimethyl-2-(pyridin-4-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c(C)n(c2c1c1nc(nn1cn2)c1ccncc1)Cc1ccco1

STK855198
Synonyms: 5-methoxy-2-[(2E)-3-(2-methoxyphenyl)prop-2-enoyl]phenyl2-bromobenzoate
Smiles: COc1ccc(c(c1)OC(=O)c1ccccc1Br)C(=O)/C=C/c1ccccc1OC

STK612439
Synonyms: 4-{2-[3-fluoro-4-(propan-2-yloxy)phenyl]-2-oxoethyl}-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CC(Oc1ccc(cc1F)C(=O)CN1C(=O)COc2c(C1=O)cccc2)C

STK612440
Synonyms: 4-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1n1c(=S)[nH]nc1c1ccco1)Cl

STK612441
Synonyms: N-[(2S)-1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-oxopropan-2-yl]-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: COc1cc(CCNC(=O)[C@@H](NC(=O)N2CC(=Nc3c2cccc3)O)C)ccc1OC

STK855200
Synonyms: phenyl(3-carbamoyl-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)carbamate
Smiles: O=C(Nc1sc2c(c1C(=O)N)CC(OC2)(C)C)Oc1ccccc1

STK855201
Synonyms: N-(5-methyl-1,3-thiazol-2-yl)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide
Smiles: O=C(Nc1ncc(s1)C)CCc1onc(n1)c1ccccc1

STK612444
Synonyms: (5E)-5-benzylidene-3-{3-[2-(2-hydroxyethyl)piperidin-1-yl]-3-oxopropyl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: OCCC1CCCCN1C(=O)CCN1C(=S)S/C(=C/c2ccccc2)/C1=O

STK612445
Synonyms: 7-(furan-2-ylmethyl)-5,6-dimethyl-3-phenyl-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1c(C)n(c2c1c(=N)n(cn2)c1ccccc1)Cc1ccco1

STK612447
Synonyms: 1-(2-methylpropyl)-3-{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
Smiles: N#Cc1c(nc(c2c1CCC2)CC(C)C)N1CCN(CC1)CC(=O)N1CCOCC1

STK612453
Synonyms: 5-({[(2-carboxyphenyl)sulfanyl]acetyl}amino)-2-chlorobenzoicacid
Smiles: O=C(Nc1ccc(c(c1)C(=O)O)Cl)CSc1ccccc1C(=O)O

STK612455
Synonyms: N-[2-([1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Smiles: O=S(=O)(c1ccc2c(c1)OCCO2)NCCc1csc2n1ncn2

STK612456
Synonyms: N-(2,4-dichlorophenyl)-2-(4-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-1-yl)acetamide
Smiles: O=C(CN1C(=O)CN(C(=O)c2c1cccc2)C)Nc1ccc(cc1Cl)Cl

STK612459
Synonyms: 3,4-diethoxy-N-[2-([1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl]benzamide
Smiles: CCOc1cc(ccc1OCC)C(=O)NCCc1csc2n1ncn2

STK612461
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)Nc1ccc2c(c1)OCCO2

STK612462
Synonyms: 5-(furan-2-ylmethyl)-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Smiles: O=c1n(cnc2c1cnn2c1ccccc1)Cc1ccco1

STK612468
Synonyms: N-{[1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]carbonyl}-L-alanyl-L-alanine
Smiles: O=C([C@@H](NC(=O)C1CC(=O)N(C1)c1ccc(cc1)F)C)N[C@H](C(=O)O)C

STK612469
Synonyms: (2S)-N-(1H-benzimidazol-2-yl)-3-methyl-2-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: CC([C@H](n1cnc2c(c1=O)cccc2)C(=O)Nc1nc2c([nH]1)cccc2)C

STK612474
Synonyms: 5-[(2-chloro-4-fluorobenzyl)oxy]-2-[5-(2-ethoxyphenoxy)pyrimidin-4-yl]phenol
Smiles: CCOc1ccccc1Oc1cncnc1c1ccc(cc1O)OCc1ccc(cc1Cl)F

STK612475
Synonyms: 2-[(3Z)-2-oxo-3-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)propyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(/C=C/1\NCCc2c1cc1OCCCOc1c2)CN1C(=O)c2c(C1=O)cccc2

STK612478
Synonyms: (2Z)-2-benzylidene-4-methyl-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: Cc1cc([O-])c(c2c1C(=O)/C(=C/c1ccccc1)/O2)C[NH+]1CCOCC1

STK612480
Synonyms: 5-chloro-N-(2,3-dichlorophenyl)-2-[(4-fluorobenzyl)sulfanyl]pyrimidine-4-carboxamide
Smiles: Fc1ccc(cc1)CSc1ncc(c(n1)C(=O)Nc1cccc(c1Cl)Cl)Cl

STK612484
Synonyms: N-(2,4-dimethoxyphenyl)-2-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)O

STK612485
Synonyms: ethyl1-[(7,8-dimethyl-2-oxo-2H-chromen-4-yl)methyl]piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2C)C

STK612488
Synonyms: 1-ethyl-3-[(1-hydroxybutan-2-yl)amino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: CCC(Nc1nc(CC)c2c(c1C#N)CCCC2)CO

STK855206
Synonyms: 5-chloro-N-(2,6-dimethylphenyl)-2-[(4-fluorobenzyl)sulfanyl]pyrimidine-4-carboxamide
Smiles: O=C(c1nc(SCc2ccc(cc2)F)ncc1Cl)Nc1c(C)cccc1C

STK612489
Synonyms: 5-benzyl-2,6-dihydroxy-5-[2-(pyridin-4-yl)ethyl]pyrimidin-4(5H)-one
Smiles: OC1=NC(=O)C(C(=N1)O)(CCc1ccncc1)Cc1ccccc1

STK612490
Synonyms: 7,9-dimethyl-N-(propan-2-yl)pyrido[3',2':4,5]furo[3,2-d]pyrimidin-4-amine
Smiles: CC(Nc1ncnc2c1oc1c2c(C)cc(n1)C)C

STK612492
Synonyms: [5-chloro-6-oxo-1-(propan-2-yl)-1,6-dihydropyridazin-4-yl](1-methyl-1H-benzimidazol-2-yl)acetonitrile
Smiles: N#CC(c1nc2c(n1C)cccc2)c1cnn(c(=O)c1Cl)C(C)C

STK612494
Synonyms: ethyl4-[(5-{2-hydroxy-4-[(3-methoxybenzyl)oxy]phenyl}-3-methyl-1H-pyrazol-4-yl)oxy]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1cccc(c1)OC

STK612496
Synonyms: 4-[2-(5-methyl-1-phenyl-1H-pyrazol-4-yl)-2-oxoethyl]-2-propyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCCC1Oc2ccccc2C(=O)N(C1=O)CC(=O)c1cnn(c1C)c1ccccc1

STK612497
Synonyms: 3-benzyl-5,6-dimethyl-7-(pyridin-3-yl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1n(c2cccnc2)c2c(c1C)c(=N)n(cn2)Cc1ccccc1

STK855209
Synonyms: 6-(furan-2-yl)-3-(pyrazin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: c1cnc(cn1)c1nnc2n1nc(s2)c1ccco1

STK612502
Synonyms: N-benzyl-3-oxo-2-(pyridin-3-ylmethyl)-2,3-dihydro-1H-isoindole-4-carboxamide
Smiles: O=C1N(Cc2cccnc2)Cc2c1c(ccc2)C(=O)NCc1ccccc1

STK612504
Synonyms: N-[(2S)-4-(methylsulfanyl)-1-oxo-1-(propan-2-ylamino)butan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide
Smiles: CSCC[C@@H](C(=O)NC(C)C)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1

STK612505
Synonyms: 5-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethoxy}-2-(3-methyl-4-phenyl-1H-pyrazol-5-yl)phenol
Smiles: Clc1cccc(c1)N1CCN(CC1)CCOc1ccc(c(c1)O)c1[nH]nc(c1c1ccccc1)C

STK612509
Synonyms: ethyl4-[(5-{4-[(2-fluorobenzyl)oxy]-2-hydroxyphenyl}-3-methyl-1H-pyrazol-4-yl)oxy]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1ccccc1F

STK612516
Synonyms: 3-[2-(diethylamino)ethyl]-4-imino-5-(4-methylphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: CCN(CCn1cnc2c(c1=N)C(c1ccc(cc1)C)c1c(O2)cc(cc1)O)CC

STK612518
Synonyms: N-[2-(2,3-dimethylimidazo[1,2-b][1,2,4]triazin-6-yl)ethyl]-3-fluoro-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1F)S(=O)(=O)NCCc1cn2c(n1)nc(c(n2)C)C

STK612520
Synonyms: 1-(2-{[3-(4-chlorophenyl)-2-oxo-2H-chromen-7-yl]oxy}ethyl)piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)CCOc1ccc2c(c1)oc(=O)c(c2)c1ccc(cc1)Cl

STK612521
Synonyms: N-{(2S)-1-[(4-fluorobenzyl)amino]-3-methyl-1-oxobutan-2-yl}-1-(phenylsulfonyl)piperidine-4-carboxamide
Smiles: CC([C@@H](C(=O)NCc1ccc(cc1)F)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1)C

STK612523
Synonyms: 4-({[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}methyl)benzoicacid
Smiles: COc1cc(/C=C/C(=O)NCc2ccc(cc2)C(=O)O)ccc1O

STK612532
Synonyms: 1-(3-methoxyphenyl)-3-[(2E)-5-octyl-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: CCCCCCCCc1n[nH]/c(=N\C(=O)Nc2cccc(c2)OC)/s1

STK612534
Synonyms: 2-[(6-chloro-3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-[2-(5-fluoro-1H-indol-3-yl)ethyl]acetamide
Smiles: O=C(COc1cc2oc(=O)c(c(c2cc1Cl)C)C)NCCc1c[nH]c2c1cc(F)cc2

STK612535
Synonyms: 6-benzyl-5-methyl-7-(4-methylpiperazin-1-yl)[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CN1CCN(CC1)c1c(Cc2ccccc2)c(C)nc2n1ncn2

STK612536
Synonyms: 3-(2-chlorophenyl)-N,N,2,5-tetramethylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Cc1cc(N(C)C)n2c(n1)c(c(n2)C)c1ccccc1Cl

STK612539
Synonyms: 2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)-N-[3-(4-methoxyphenyl)-1H-1,2,4-triazol-5-yl]acetamide
Smiles: COc1ccc(cc1)c1n[nH]c(n1)NC(=O)Cc1c(=O)oc2c(c1C)c(O)cc(c2)C

STK612540
Synonyms: N,7-bis(2-methoxyphenyl)-5-methyl-2-(methylsulfanyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1ccccc1C1C(=C(C)N=c2n1nc([nH]2)SC)C(=O)Nc1ccccc1OC

STK612546
Synonyms: N'-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetyl]-4-fluorobenzohydrazide
Smiles: O=C(Cc1nn2c(n1)nc(cc2C)C)NNC(=O)c1ccc(cc1)F

STK612547
Synonyms: 4-[2-(2-methoxyphenyl)-2-oxoethyl]-2-propyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCCC1Oc2ccccc2C(=O)N(C1=O)CC(=O)c1ccccc1OC

STK612550
Synonyms: N-(1,3-benzodioxol-5-yl)-1-(9H-purin-6-yl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1ncnc2c1nc[nH]2)Nc1ccc2c(c1)OCO2

STK612551
Synonyms: N-(1H-benzimidazol-2-yl)-2-[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(Nc1nc2c([nH]1)cccc2)COc1ccc2c(c1C)oc(=O)c(c2C)C

STK612552
Synonyms: N-(2-hydroxy-2-phenylethyl)-2-[(2-oxo-2H-chromen-7-yl)oxy]propanamide
Smiles: O=C(C(Oc1ccc2c(c1)oc(=O)cc2)C)NCC(c1ccccc1)O

STK612553
Synonyms: 6-[(2Z)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)acetyl]pyridazin-3(2H)-one
Smiles: O=C(c1ccc(=O)[nH]n1)/C=C/1\NCCc2c1cc1OCOc1c2

STK612554
Synonyms: (4-phenylpiperazin-1-yl)[1-(9H-purin-6-yl)piperidin-3-yl]methanone
Smiles: O=C(C1CCCN(C1)c1ncnc2c1nc[nH]2)N1CCN(CC1)c1ccccc1

STK612558
Synonyms: N'-[(3-chloro-1-benzothiophen-2-yl)carbonyl]-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridazine-3-carbohydrazide
Smiles: O=C1CCC(=NN1c1ccccc1)C(=O)NNC(=O)c1sc2c(c1Cl)cccc2

STK612562
Synonyms: 2,3-dimethyl-N-(pyridin-4-yl)-1H-indole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)Nc1ccncc1

STK612563
Synonyms: N-(6-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-6-oxohexyl)-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: O=C(NCCC1=CCCCC1)CCCCCNC(=O)N1CCn2c1nc1c2cccc1

STK612565
Synonyms: N-[(5-hydroxy-1-phenyl-1H-pyrazol-3-yl)methyl]-3-(4-methoxyphenyl)propanamide
Smiles: COc1ccc(cc1)CCC(=O)NCc1nn(c(c1)O)c1ccccc1

STK612567
Synonyms: 1-[1-hydroxy-3,3-dimethyl-11-(pyridin-2-yl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone
Smiles: OC1=C2C(=Nc3c(N(C2c2ccccn2)C(=O)C)cccc3)CC(C1)(C)C

STK612570
Synonyms: methyl1-[(7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)methyl]piperidine-4-carboxylate
Smiles: COC(=O)C1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2C)O

STK612571
Synonyms: N-[3-(1H-benzimidazol-2-yl)-1-(2-methoxyethyl)-4,5-dimethyl-1H-pyrrol-2-yl]butanamide
Smiles: COCCn1c(C)c(c(c1NC(=O)CCC)c1nc2c([nH]1)cccc2)C

STK612572
Synonyms: 5-[(4-ethenylbenzyl)oxy]-2-[4-(2-methoxyphenyl)-3-methyl-1H-pyrazol-5-yl]phenol
Smiles: COc1ccccc1c1c(C)n[nH]c1c1ccc(cc1O)OCc1ccc(cc1)C=C

STK612573
Synonyms: 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]-N-(pyridin-2-ylmethyl)propanamide
Smiles: CCCCc1cc(=O)oc2c1c(cc(c2)C)OC(C(=O)NCc1ccccn1)C

STK612574
Synonyms: 4-{[(6'-methyl-8'-oxo-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-7'-yl)acetyl]amino}butanoicacid
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2)NCCCC(=O)O

STK612576
Synonyms: 2-[(5Z)-5-(furan-2-ylmethylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]acetamide
Smiles: OCC(Cc1ccccc1)NC(=O)CN1C(=O)S/C(=C\c2ccco2)/C1=O

STK612578
Synonyms: 2-(3-methyl-4-phenyl-1H-pyrazol-5-yl)-5-[2-(3-methylpiperidin-1-yl)ethoxy]phenol
Smiles: CC1CCCN(C1)CCOc1ccc(c(c1)O)c1[nH]nc(c1c1ccccc1)C

STK612581
Synonyms: (5Z)-3-{3-[2-(2-hydroxyethyl)piperidin-1-yl]-3-oxopropyl}-5-(2-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: OCCC1CCCCN1C(=O)CCN1C(=S)S/C(=C\c2ccccc2OC)/C1=O

STK612582
Synonyms: 8,9-dimethyl-7-(pyridin-2-yl)-2-(pyridin-4-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1n(c2ccccn2)c2c(c1C)c1nc(nn1cn2)c1ccncc1

STK612584
Synonyms: 6-(4-chlorophenyl)-5,6-dihydrobenzimidazo[1,2-c]quinazoline
Smiles: Clc1ccc(cc1)C1Nc2ccccc2c2n1c1ccccc1n2

STK612586
Synonyms: 2-{2-[({[(E)-(4-chlorophenyl)methylidene]amino}oxy)methyl]-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl}-N,N-dimethylethanamine
Smiles: CN(CCn1c(C)c(c2c1ncn1c2nc(n1)CO/N=C/c1ccc(cc1)Cl)C)C

STK612587
Synonyms: N-(2-methoxyethyl)-N'-[2-oxo-1-(propan-2-yl)-2,3-dihydro-1H-indol-3-yl]ethanediamide
Smiles: COCCNC(=O)C(=O)NC1c2ccccc2N(C1=O)C(C)C

STK612591
Synonyms: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl)piperazin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
Smiles: N#Cc1c(nc(c2c1CCC2)c1ccccc1)N1CCN(CC1)CC(=O)Nc1nccs1

STK612592
Synonyms: 2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)-N-[3-(1H-imidazol-1-yl)propyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(O)cc(c2)C)NCCCn1cncc1

STK612593
Synonyms: 1-methyl-3-(piperazin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(nc(c2c1CCCC2)C)N1CCNCC1

STK612595
Synonyms: ethyl5,5-dimethyl-2-{[(4-methylpiperazin-1-yl)carbonyl]amino}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)N2CCN(CC2)C)sc2c1CC(C)(C)OC2

STK612599
Synonyms: 7-(2-bromoethoxy)-3-(4-methoxyphenyl)-4H-chromen-4-one
Smiles: BrCCOc1ccc2c(c1)occ(c2=O)c1ccc(cc1)OC

STK612601
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-Nalpha-[(3-methylphenyl)acetyl]phenylalaninamide
Smiles: O=C(NC(C(=O)NCc1cc(=O)n(c(=O)n1C)C)Cc1ccccc1)Cc1cccc(c1)C

STK612602
Synonyms: (3R)-4-({[1-(tert-butoxycarbonyl)piperidin-4-yl]carbonyl}amino)-3-(4-chlorophenyl)butanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)Cl)CNC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK612610
Synonyms: 2-{3-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]-1H-indol-1-yl}-N-(4-fluorophenyl)acetamide
Smiles: Fc1ccc(cc1)NC(=O)Cn1cc(c2c1cccc2)/C=C/c1nc(O)nc(c1[N+](=O)[O-])O

STK612611
Synonyms: 3-[(4-{(Z)-[1-(3,5-dimethylphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-2-methoxyphenoxy)methyl]benzoicacid
Smiles: COc1cc(ccc1OCc1cccc(c1)C(=O)O)/C=C\1/C(=NC(=O)N(C1=O)c1cc(C)cc(c1)C)O

STK855219
Synonyms: 5-[(4-fluorobenzyl)amino]-2-[(2-methoxyphenoxy)methyl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NCc1ccc(cc1)F)COc1ccccc1OC

STK612615
Synonyms: 2-{[(2-hydroxyethyl)(methyl)carbamoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylicacid
Smiles: OCCN(C(=O)Nc1sc2c(c1C(=O)O)CCC2)C

STK612616
Synonyms: 5-(3,5-difluorophenyl)-4-hydroxy-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C1Nc2nc(nc(c2C(C1)c1cc(F)cc(c1)F)O)c1ccccc1

STK612617
Synonyms: N-(2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-1-ylcarbonyl)-L-methionylglycine
Smiles: CSCC[C@@H](C(=O)NCC(=O)O)NC(=O)N1CCn2c1nc1c2cccc1

STK612618
Synonyms: (2E)-2-(1H-benzimidazol-2-yl)-3-[2-(4-methylpiperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1c(nc2n(c1=O)cccc2)N1CCN(CC1)C)/c1nc2c([nH]1)cccc2

STK612619
Synonyms: 7-[2-(dimethylamino)ethyl]-5,6-dimethyl-N-(pyridin-3-ylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: CN(CCn1c(C)c(c2c1ncnc2NCc1cccnc1)C)C

STK855220
Synonyms: 5-{4-[(4-chlorophenyl)carbonyl]piperazin-1-yl}-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccc(cc1)Cl)c1ccco1

STK612623
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-3-fluorobenzamide
Smiles: Fc1cccc(c1)C(=O)NCc1cc(=O)n(c(=O)n1C)C

STK612624
Synonyms: 1-{3-[(5Z)-5-(2-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]propanoyl}piperidine-2-carboxylicacid
Smiles: COc1ccccc1/C=C/1\SC(=O)N(C1=O)CCC(=O)N1CCCCC1C(=O)O

STK855221
Synonyms: 2-[4-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-5-[2-(morpholin-4-yl)ethoxy]phenol
Smiles: COc1cc(ccc1OC)c1c[nH]nc1c1ccc(cc1O)OCCN1CCOCC1

STK612625
Synonyms: (4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(3-nitrophenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: Cc1cccc(c1)COc1ccc(cc1)/C(=C\1/C(c2cccc(c2)[N+](=O)[O-])N(C(=O)C1=O)Cc1cccnc1)/O

STK612626
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-Nalpha-[(2,4,6-trimethylphenyl)sulfonyl]phenylalaninamide
Smiles: Cc1cc(C)c(c(c1)C)S(=O)(=O)NC(C(=O)NCc1cc(=O)n(c(=O)n1C)C)Cc1ccccc1

STK612629
Synonyms: 2-[(4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy]-N-(pyridin-3-yl)acetamide
Smiles: O=C(Nc1cccnc1)COc1ccc2c(c1C)oc(=O)c1c2cccc1

STK612633
Synonyms: 3-[2-(dimethylamino)ethyl]-4-imino-5-phenyl-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: CN(CCn1cnc2c(c1=N)C(c1ccccc1)c1c(O2)cc(cc1)O)C

STK612634
Synonyms: (2-{[(2Z)-3-(3-chloro-4-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-2-oxoethoxy)aceticacid
Smiles: OC(=O)COCC(=O)/N=C/1\SC2C(N1c1ccc(c(c1)Cl)F)CS(=O)(=O)C2

STK612635
Synonyms: 2-{[4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl]oxy}-N-(pyridin-3-yl)acetamide
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1ccc(c2)OCC(=O)Nc1cccnc1

STK855222
Synonyms: 2-(4-nitrophenyl)-5-(pyrrolidin-1-yl)-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCCC1)c1ccc(cc1)[N+](=O)[O-]

STK855223
Synonyms: 2-(2-methoxyphenyl)-5-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1cccs1)c1ccccc1OC

STK612640
Synonyms: 7-[(3-chlorobenzyl)oxy]-3-(3,4-dimethoxyphenyl)-2-methyl-4H-chromen-4-one
Smiles: COc1cc(ccc1OC)c1c(C)oc2c(c1=O)ccc(c2)OCc1cccc(c1)Cl

STK612644
Synonyms: methyl1-[(3-oxo-3H-benzo[f]chromen-1-yl)methyl]piperidine-4-carboxylate
Smiles: COC(=O)C1CCN(CC1)Cc1cc(=O)oc2c1c1ccccc1cc2

STK612645
Synonyms: 2,4-dichloro-N-[(2Z)-5-(methylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)/N=c\1/[nH]nc(s1)S(=O)(=O)C

STK855225
Synonyms: 5-{4-[(3-chlorophenyl)carbonyl]piperazin-1-yl}-2-phenyl-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1cccc(c1)Cl)c1ccccc1

STK612650
Synonyms: N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-2,3-dimethyl-1H-indole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)/N=c/1\sc2c([nH]1)cccc2

STK612651
Synonyms: 3-(3-methoxyphenyl)-5-methyl-2-(phenylamino)furo[3,2-c]quinolin-4(5H)-one
Smiles: COc1cccc(c1)c1c(Nc2ccccc2)oc2c1c(=O)n(c1c2cccc1)C

STK612654
Synonyms: 3-[2-(dimethylamino)ethyl]-4-imino-5-(4-methylphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: CN(CCn1cnc2c(c1=N)C(c1ccc(cc1)C)c1c(O2)cc(cc1)O)C

STK612655
Synonyms: 4-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]amino}butanoicacid
Smiles: O=C(Cn1nnc2c(c1=O)cccc2)NCCCC(=O)O

STK612660
Synonyms: 4-chloro-2-methyl-5-(morpholin-4-yl)pyridazin-3(2H)-one
Smiles: Clc1c(cnn(c1=O)C)N1CCOCC1

STK612666
Synonyms: 4-{8,9-dimethyl-7-[3-(morpholin-4-yl)propyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl}-N,N-dimethylaniline
Smiles: CN(c1ccc(cc1)c1nn2c(n1)c1c(nc2)n(c(c1C)C)CCCN1CCOCC1)C

STK612668
Synonyms: 2-[(4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-[3-(morpholin-4-yl)propyl]propanamide
Smiles: CCc1cc(=O)oc2c1ccc(c2C)OC(C(=O)NCCCN1CCOCC1)C

STK612670
Synonyms: N'-(6-benzyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-N,N-dimethylbenzene-1,4-diamine
Smiles: Cc1nc2ncnn2c(c1Cc1ccccc1)Nc1ccc(cc1)N(C)C

STK855227
Synonyms: N-{2-[2-oxo-6-(propan-2-yl)-2H-chromen-4-yl]-1-benzofuran-3-yl}furan-2-carboxamide
Smiles: O=c1oc2ccc(cc2c(c1)c1oc2c(c1NC(=O)c1ccco1)cccc2)C(C)C

STK612671
Synonyms: 7-benzyl-4-(3,5-dimethyl-1H-pyrazol-1-yl)-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidine
Smiles: Cc1cc(n(n1)c1ncnc2c1c(C)c(n2Cc1ccccc1)C)C

STK612672
Synonyms: 3-[2-(4-chlorophenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl]-N,N-dimethylpropan-1-amine
Smiles: CN(CCCn1c(C)c(c2c1ncn1c2nc(n1)c1ccc(cc1)Cl)C)C

STK612673
Synonyms: 3-ethoxy-N-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: CCOc1cccc(c1)C(=O)Nc1nnc(s1)S(=O)(=O)C

STK612679
Synonyms: methyl2-hydroxy-6-(4-hydroxy-3-methoxyphenyl)-5-(phenylcarbonyl)-1,6-dihydropyrimidine-4-carboxylate
Smiles: COC(=O)C1=C(C(NC(=N1)O)c1ccc(c(c1)OC)O)C(=O)c1ccccc1

STK612680
Synonyms: N-cycloheptyl-2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)NC1CCCCCC1

STK612683
Synonyms: 3-hydroxy-N-(3-oxo-3-{[3-(trifluoromethyl)benzyl]amino}propyl)quinoxaline-1(2H)-carboxamide
Smiles: O=C(NCc1cccc(c1)C(F)(F)F)CCNC(=O)N1CC(=Nc2c1cccc2)O

STK855230
Synonyms: 5-[(phenylsulfonyl)methyl]-1-[3-(trifluoromethyl)phenyl]-1H-tetrazole
Smiles: O=S(=O)(c1ccccc1)Cc1nnnn1c1cccc(c1)C(F)(F)F

STK612685
Synonyms: ethyl4-{[3-(methoxycarbonyl)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl]carbamoyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)Nc1sc2c(c1C(=O)OC)CC(OC2)(C)C

STK612687
Synonyms: (2E)-3-(5-ethylthiophen-2-yl)-N-(quinoxalin-6-yl)prop-2-enamide
Smiles: CCc1ccc(s1)/C=C/C(=O)Nc1ccc2c(c1)nccn2

STK612688
Synonyms: 3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-1-(pyrrolidin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCCN2CCOCC2)nc(c2c1CCCC2)N1CCCC1

STK612691
Synonyms: 1-(9H-purin-6-yl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1ncnc2c1nc[nH]2)NCc1cccnc1

STK612694
Synonyms: methyl2-{[(5,5-dioxido-1-phenyl-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl)sulfanyl]methyl}-4-hydroxyquinazoline-7-carboxylate
Smiles: COC(=O)c1ccc2c(c1)nc(nc2O)CSC1=NC2C(N1c1ccccc1)CS(=O)(=O)C2

STK612700
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonyl}piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)S(=O)(=O)c1ccc(cc1)N1CCCC1=O)Nc1ccc2c(c1)OCCO2

STK855231
Synonyms: 1-(4-chlorophenyl)-N-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: CC(Cc1n[nH]/c(=N/C(=O)c2nn(ccc2=O)c2ccc(cc2)Cl)/s1)C

STK612702
Synonyms: 3-[4-imino-5,6-dimethyl-3-(2-methylpropyl)-3,4-dihydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl]-N,N-dimethylpropan-1-amine
Smiles: CN(CCCn1c(C)c(c2c1ncn(c2=N)CC(C)C)C)C

STK612703
Synonyms: 2-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N'-[(naphthalen-2-yloxy)acetyl]acetohydrazide
Smiles: O=C(COc1ccc2c(c1)cccc2)NNC(=O)Cc1nn2c(n1)nc(cc2C)C

STK612715
Synonyms: N-(2-hydroxy-2-phenylethyl)-2-[(6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]acetamide
Smiles: O=C(COc1ccc2c(c1)oc(=O)c1c2CCCC1)NCC(c1ccccc1)O

STK612718
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-{[5-(4-fluorophenyl)furan-2-yl]methyl}propanamide
Smiles: CCC(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(o1)c1ccc(cc1)F

STK612720
Synonyms: 1-[(9-oxoacridin-10(9H)-yl)acetyl]piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)C(=O)Cn1c2ccccc2c(=O)c2c1cccc2

STK612722
Synonyms: 1-(3,4-dimethoxyphenyl)-6-methoxy-2-(1,3-thiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)c1nccs1)c1ccc(c(c1)OC)OC

STK612726
Synonyms: 3-(2,4-dichlorophenyl)-6-ethoxy[1,2,4]triazolo[4,3-b]pyridazine
Smiles: CCOc1ccc2n(n1)c(nn2)c1ccc(cc1Cl)Cl

STK612730
Synonyms: (3aS,6R,7aR)-N-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: COc1ccc(cc1)N1C[C@@]23[C@H](C1=O)C([C@@H](O3)C=C2)C(=O)Nc1ccc2c(c1)OCO2

STK612732
Synonyms: 6-chloro-8-{[(2,4-dimethoxybenzyl)amino]methyl}-7-hydroxy-3,4-dimethyl-2H-chromen-2-one
Smiles: COc1ccc(c(c1)OC)CNCc1c(O)c(Cl)cc2c1oc(=O)c(c2C)C

STK612733
Synonyms: 2-(7,8-dihydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[3-(1H-imidazol-1-yl)propyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2O)O)NCCCn1cncc1

STK612735
Synonyms: 8,9-dimethyl-7-(pyridin-2-yl)-2-(thiophen-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c(C)n(c2c1c1nc(nn1cn2)c1cccs1)c1ccccn1

STK612737
Synonyms: 3-[7-chloro-4-(2-methylpropyl)-3-oxo-3,4-dihydroquinoxalin-2-yl]-N-[4-(morpholin-4-yl)phenyl]propanamide
Smiles: CC(Cn1c(=O)c(CCC(=O)Nc2ccc(cc2)N2CCOCC2)nc2c1ccc(c2)Cl)C

STK855236
Synonyms: N-{4-[1-(2,2-dimethylpropanoyl)-5-(2-methylphenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
Smiles: O=C(C(C)(C)C)N1N=C(CC1c1ccccc1C)c1ccc(cc1)NS(=O)(=O)C

STK612744
Synonyms: 7,7'-[ethane-1,2-diylbis(oxy)]bis[3-(4-bromophenyl)-4H-chromen-4-one]
Smiles: Brc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCCOc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Br

STK612748
Synonyms: 7-benzyl-5,6-dimethyl-4-(morpholin-4-yl)-7H-pyrrolo[2,3-d]pyrimidine
Smiles: Cc1n(Cc2ccccc2)c2c(c1C)c(ncn2)N1CCOCC1

STK612750
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-Nalpha-(phenylacetyl)phenylalaninamide
Smiles: O=C(NC(C(=O)NCc1cc(=O)n(c(=O)n1C)C)Cc1ccccc1)Cc1ccccc1

STK855238
Synonyms: 3-[(3-chloro-2-methylphenyl)amino]-1,2,4-triazin-5-ol
Smiles: Oc1cnnc(n1)Nc1cccc(c1C)Cl

STK612751
Synonyms: 3-(3,4-dimethoxyphenyl)-7-[(4-nitrobenzyl)oxy]-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: COc1ccc(cc1OC)c1c(=O)c2ccc(cc2oc1C(F)(F)F)OCc1ccc(cc1)[N+](=O)[O-]

STK855239
Synonyms: 2-(4-chlorophenyl)-5-{4-[(3-chlorophenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1cccc(c1)Cl)c1ccc(cc1)Cl

STK612755
Synonyms: 1-{2-[(E)-2-(2-methoxyphenyl)ethenyl]-4-(phenylsulfonyl)-1,3-oxazol-5-yl}-4-methylpiperazine
Smiles: COc1ccccc1/C=C/c1oc(c(n1)S(=O)(=O)c1ccccc1)N1CCN(CC1)C

STK612757
Synonyms: ethyl[(5,5-dioxido-1-phenyl-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSC1=NC2C(N1c1ccccc1)CS(=O)(=O)C2

STK612758
Synonyms: (E)-1-(2-chlorophenyl)-N-{[8,9-dimethyl-7-(pyridin-3-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}methanimine
Smiles: Clc1ccccc1/C=N/OCc1nc2n(n1)cnc1c2c(C)c(n1c1cccnc1)C

STK612759
Synonyms: 2-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]-2-ethoxyphenoxy}-N-[3-(methylsulfanyl)phenyl]acetamide
Smiles: CCOc1cc(ccc1OCC(=O)Nc1cccc(c1)SC)/C=C/c1nc(O)nc(c1[N+](=O)[O-])O

STK855241
Synonyms: 4-[4-(3,4-dimethoxyphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzene-1,3-diol
Smiles: COc1cc(ccc1OC)c1c([nH]nc1C(F)(F)F)c1ccc(cc1O)O

STK612763
Synonyms: N-[(1Z)-1-(2-methyl-1,1-dioxido-4-oxo-2H-1,2-benzothiazin-3(4H)-ylidene)ethyl]propanamide
Smiles: CCC(=O)N/C(=C\1/C(=O)c2ccccc2S(=O)(=O)N1C)/C

STK612764
Synonyms: 2-[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Smiles: O=C(Nc1noc(c1)C)COc1ccc2c(c1)oc(=O)c(c2C)C

STK612765
Synonyms: N-{1-methyl-2-[2-(2-oxopyrrolidin-1-yl)ethyl]-1H-benzimidazol-5-yl}furan-2-carboxamide
Smiles: O=C1CCCN1CCc1nc2c(n1C)ccc(c2)NC(=O)c1ccco1

STK612766
Synonyms: 2-[(5Z)-5-(2-fluorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[2-(4-hydroxyphenyl)ethyl]acetamide
Smiles: O=C(CN1C(=O)S/C(=C\c2ccccc2F)/C1=O)NCCc1ccc(cc1)O

STK612768
Synonyms: 6-(4-methoxybenzyl)-3-{[2-(morpholin-4-yl)ethyl]amino}-1,2,4-triazin-5-ol
Smiles: COc1ccc(cc1)Cc1nnc(nc1O)NCCN1CCOCC1

STK612770
Synonyms: 2-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-ol
Smiles: CN1CCN(CC1)c1nc(O)c2c(n1)CCC2

STK612771
Synonyms: 5-[(4-ethenylbenzyl)oxy]-2-[4-(3-methoxyphenoxy)-1H-pyrazol-5-yl]phenol
Smiles: C=Cc1ccc(cc1)COc1ccc(c(c1)O)c1[nH]ncc1Oc1cccc(c1)OC

STK612772
Synonyms: N'-[2-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetyl]pyridine-4-carbohydrazide
Smiles: O=C(Cc1nn2c(n1)nc(cc2C)C)NNC(=O)c1ccncc1

STK612773
Synonyms: (2E)-1-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one
Smiles: O=C(N1CCN(CC1)c1nsc2c1cccc2)/C=C/c1cccc(c1)C(F)(F)F

STK612776
Synonyms: 3-{4,8-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}-N-(1,3-thiazol-2-yl)propanamide
Smiles: O=C(Nc1nccs1)CCc1c(=O)oc2c(c1C)ccc(c2C)OCC=C(C)C

STK612778
Synonyms: 3-hydroxy-N-{4-oxo-4-[(3-phenylpropyl)amino]butyl}quinoxaline-1(2H)-carboxamide
Smiles: O=C(NCCCc1ccccc1)CCCNC(=O)N1CC(=Nc2c1cccc2)O

STK855242
Synonyms: 2-(furan-2-yl)-5-[4-(phenylcarbonyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccccc1)c1ccco1

STK612787
Synonyms: 3-{8,9-dimethyl-2-[({[(1Z)-1-phenylethylidene]amino}oxy)methyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl}-N,N-dimethylpropan-1-amine
Smiles: CN(CCCn1c(C)c(c2c1ncn1c2nc(n1)CO/N=C(\c1ccccc1)/C)C)C

STK612788
Synonyms: N-[3-oxo-3-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)propyl]-3-(trifluoromethyl)benzamide
Smiles: O=C(N1CCC2(CC1)NCCc1c2[nH]cn1)CCNC(=O)c1cccc(c1)C(F)(F)F

STK612789
Synonyms: N-{5-[(2-fluorobenzyl)sulfonyl]-1,3,4-thiadiazol-2-yl}-3-methylbutanamide
Smiles: CC(CC(=O)Nc1nnc(s1)S(=O)(=O)Cc1ccccc1F)C

STK612791
Synonyms: N-benzyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Smiles: O=C(c1ccc2c(c1)[nH]c(=O)c(=O)[nH]2)NCc1ccccc1

STK612792
Synonyms: 2-(2,3-dimethylphenoxy)-N'-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetyl]acetohydrazide
Smiles: O=C(COc1cccc(c1C)C)NNC(=O)Cc1nc2n(n1)c(C)cc(n2)C

STK612794
Synonyms: 3-hydroxy-N-{3-[(2-methylcyclohexyl)amino]-3-oxopropyl}quinoxaline-1(2H)-carboxamide
Smiles: O=C(NC1CCCCC1C)CCNC(=O)N1CC(=Nc2c1cccc2)O

STK612795
Synonyms: 5-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}-4-hydroxy-2-methyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: COc1cc(ccc1OCc1ccccc1F)C1CC(=O)Nc2c1c(O)nc(n2)C

STK612796
Synonyms: 6-benzyl-3-[(tetrahydrofuran-2-ylmethyl)amino]-1,2,4-triazin-5-ol
Smiles: Oc1nc(NCC2CCCO2)nnc1Cc1ccccc1

STK612800
Synonyms: 7-benzyl-8,9-dimethyl-2-(pyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c(C)c2c(n1Cc1ccccc1)ncn1c2nc(n1)c1ccccn1

STK612804
Synonyms: 1-(2-{[3-(4-chlorophenyl)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}ethyl)piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)CCOc1ccc2c(c1)oc(=O)c(c2C)c1ccc(cc1)Cl

STK612805
Synonyms: 3-methyl-N-[4-(thiophen-2-yl)-1,2,5-oxadiazol-3-yl]-1-benzofuran-2-carboxamide
Smiles: O=C(c1oc2c(c1C)cccc2)Nc1nonc1c1cccs1

STK612808
Synonyms: N-[2-(2,3-dimethylimidazo[1,2-b][1,2,4]triazin-6-yl)ethyl]methanesulfonamide
Smiles: Cc1nn2cc(nc2nc1C)CCNS(=O)(=O)C

STK855243
Synonyms: 5-chloro-N-(2,5-dimethoxyphenyl)-2-[(4-fluorobenzyl)sulfanyl]pyrimidine-4-carboxamide
Smiles: COc1ccc(cc1NC(=O)c1nc(ncc1Cl)SCc1ccc(cc1)F)OC

STK612809
Synonyms: 3-[4-(morpholin-4-yl)-4-oxobutyl]quinazolin-4(3H)-one
Smiles: O=C(N1CCOCC1)CCCn1cnc2c(c1=O)cccc2

STK612813
Synonyms: 5-[(4-bromobenzyl)oxy]-2-[5-(4-bromophenyl)pyrimidin-4-yl]phenol
Smiles: Brc1ccc(cc1)COc1ccc(c(c1)O)c1ncncc1c1ccc(cc1)Br

STK855244
Synonyms: 4-[2-(4-ethoxyphenyl)-2-oxoethyl]-2-methyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCOc1ccc(cc1)C(=O)CN1C(=O)C(C)Oc2c(C1=O)cccc2

STK612815
Synonyms: 2-(4-fluorophenoxy)-N-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]butanamide
Smiles: CCC(C(=O)Nc1nnc(s1)S(=O)(=O)C)Oc1ccc(cc1)F

STK612822
Synonyms: methyl{3-[1-(furan-2-yl)propan-2-yl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-7-yl}acetate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)OCN(C1)C(Cc1ccco1)C

STK612825
Synonyms: N-(1H-benzimidazol-2-yl)-2-[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(Nc1nc2c([nH]1)cccc2)COc1ccc2c(c1)oc(=O)c(c2C)C

STK612826
Synonyms: 4-{[(2Z)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)/N=C/1\SC2C(N1c1ccc3c(c1)OCCO3)CS(=O)(=O)C2

STK612827
Synonyms: 3-{(5Z)-5-[(8-methoxyquinolin-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoicacid
Smiles: COc1cccc2c1nc(cc2)/C=C/1\SC(=S)N(C1=O)CCC(=O)O

STK612830
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-N~2~-[(3-fluoro-4-methoxyphenyl)sulfonyl]glycinamide
Smiles: COc1ccc(cc1F)S(=O)(=O)NCC(=O)NCc1cc(=O)n(c(=O)n1C)C

STK612831
Synonyms: 4-[(Z)-{1-[4-(butan-2-yl)phenyl]-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene}methyl]benzoicacid
Smiles: CCC(c1ccc(cc1)N1C(=O)N=C(/C(=C/c2ccc(cc2)C(=O)O)/C1=O)O)C

STK612832
Synonyms: N-(4-ethylphenyl)-1-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-ylcarbonyl]piperidine-4-carboxamide
Smiles: CCc1ccc(cc1)NC(=O)C1CCN(CC1)C(=O)[C@H]1NCc2c(C1)cccc2

STK612833
Synonyms: 2-[(pyrrolidin-1-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylicacid
Smiles: O=C(N1CCCC1)Nc1sc2c(c1C(=O)O)CCCC2

STK612837
Synonyms: 5-[(2-chloro-4-fluorobenzyl)oxy]-2-[5-(4-methoxyphenyl)pyrimidin-4-yl]phenol
Smiles: COc1ccc(cc1)c1cncnc1c1ccc(cc1O)OCc1ccc(cc1Cl)F

STK612838
Synonyms: 2-[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Smiles: O=C(C(Oc1ccc2c(c1)oc(=O)c(c2C)C)C)NCCc1ccc(cc1)S(=O)(=O)N

STK612839
Synonyms: (3Z)-1-(2,5-dimethoxyphenyl)-3-(pyridin-3-ylmethylidene)pyrrolidine-2,5-dione
Smiles: COc1ccc(c(c1)N1C(=O)C/C(=C/c2cccnc2)/C1=O)OC

STK612840
Synonyms: 8,9-dimethyl-7-[2-(morpholin-4-yl)ethyl]-2-(pyridin-3-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c(C)n(c2c1c1nc(nn1cn2)c1cccnc1)CCN1CCOCC1

STK612844
Synonyms: 2-[(5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(2-oxo-2H-chromen-6-yl)acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccco2)/C1=O)Nc1ccc2c(c1)ccc(=O)o2

STK612846
Synonyms: 2-methoxyethyl2-methyl-4-(pyridin-3-yl)-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: COCCOC(=O)C1=C(C)N=c2n(C1c1cccnc1)c1ccccc1[nH]2

STK612848
Synonyms: 2-[(2-{3-[4-(propan-2-yloxy)phenyl]propanoyl}hydrazinyl)carbonyl]benzoicacid
Smiles: O=C(CCc1ccc(cc1)OC(C)C)NNC(=O)c1ccccc1C(=O)O

STK612849
Synonyms: 2-(4-chlorophenoxy)-N-{2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]ethyl}acetamide
Smiles: COc1cccc(c1)c1scc(n1)CCNC(=O)COc1ccc(cc1)Cl

STK612851
Synonyms: (E)-N-{[8,9-dimethyl-7-(2-methylpropyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}-1-phenylmethanimine
Smiles: CC(Cn1c(C)c(c2c1ncn1c2nc(n1)CO/N=C/c1ccccc1)C)C

STK612855
Synonyms: 2-[4-(3,4-dimethoxyphenyl)-3-methyl-1H-pyrazol-5-yl]-5-[2-(4-methylpiperidin-1-yl)ethoxy]phenol
Smiles: COc1ccc(cc1OC)c1c(C)n[nH]c1c1ccc(cc1O)OCCN1CCC(CC1)C

STK612860
Synonyms: 8,9-dimethyl-7-(2-methylpropyl)-2-(pyridin-4-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC(Cn1c(C)c(c2c1ncn1c2nc(n1)c1ccncc1)C)C

STK612861
Synonyms: 3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-6-methyl-1,2,4-triazin-5-ol
Smiles: COc1cc(CCNc2nnc(c(n2)O)C)ccc1OC

STK612868
Synonyms: (5E)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-2,6-dihydroxypyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C/NC2CCN(CC2)Cc2ccccc2)/C(=N1)O

STK612870
Synonyms: 7-{2-[4-(4-fluorophenyl)piperazin-1-yl]ethoxy}-2-methyl-3-phenyl-4H-chromen-4-one
Smiles: Fc1ccc(cc1)N1CCN(CC1)CCOc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK612871
Synonyms: N-(1,2,3,4-tetrahydronaphthalen-1-yl)-N~2~-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)-L-alaninamide
Smiles: O=C(NC1CCCc2c1cccc2)N[C@H](C(=O)NC1CCCc2c1cccc2)C

STK612872
Synonyms: 2-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[2-(4-hydroxyphenyl)ethyl]acetamide
Smiles: O=C(CN1C(=O)S/C(=C\c2ccc3c(c2)OCO3)/C1=O)NCCc1ccc(cc1)O

STK612876
Synonyms: 1-(2-chlorobenzyl)-N-(2-methylpropyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Smiles: CC(CNc1ncnc2c1cnn2Cc1ccccc1Cl)C

STK612877
Synonyms: 3-(4-chlorophenyl)-2,5-dimethyl-6-(3-methylbutyl)pyrazolo[1,5-a]pyrimidin-7-ol
Smiles: CC(CCc1c(C)nc2n(c1O)nc(c2c1ccc(cc1)Cl)C)C

STK612880
Synonyms: methyl{1-[2-(benzylamino)-2-oxoethyl]-2,4-dioxo-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl}acetate
Smiles: COC(=O)Cn1c(=O)c2c3CCCc3sc2n(c1=O)CC(=O)NCc1ccccc1

STK612881
Synonyms: 7-{2-[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]-2-oxoethoxy}-3,4-dimethyl-2H-chromen-2-one
Smiles: O=C(N1CCN(CC1)C(=O)C1COc2c(O1)cccc2)COc1ccc2c(c1)oc(=O)c(c2C)C

STK855252
Synonyms: 5,7-dimethyl-4-oxo-N-[(2Z)-5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4H-chromene-2-carboxamide
Smiles: C=CCSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)cc(cc3C)C)/s1

STK612882
Synonyms: 5-(2,4-dimethylphenyl)-4-hydroxy-2-methyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C1Nc2nc(C)nc(c2C(C1)c1ccc(cc1C)C)O

STK612883
Synonyms: N-[(2Z)-5-(butylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-(naphthalen-1-yl)acetamide
Smiles: CCCCS(=O)(=O)c1n[nH]/c(=N/C(=O)Cc2cccc3c2cccc3)/s1

STK612884
Synonyms: 2-(4-chlorophenoxy)-N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]acetamide
Smiles: O=C(NCc1cc(=O)n(c(=O)n1C)C)COc1ccc(cc1)Cl

STK612886
Synonyms: (5-bromofuran-2-yl)[3-(4-fluorophenyl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]methanone
Smiles: Fc1ccc(cc1)c1n[nH]c2c1CN(CC2)C(=O)c1ccc(o1)Br

STK612892
Synonyms: 3-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-1-(piperidin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCC(=O)N2CCOCC2)nc(c2c1CCCC2)N1CCCCC1

STK855255
Synonyms: 5-ethyl-6-methyl-2-[(4-methyl-7,8-dihydro-6H-cyclopenta[g]quinazolin-2-yl)amino]pyrimidin-4-ol
Smiles: CCc1c(C)nc(nc1O)Nc1nc(C)c2c(n1)cc1c(c2)CCC1

STK612895
Synonyms: 4-{[(6-chloro-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}benzoicacid
Smiles: O=C(C1OC(=O)c2c(C1)cc(cc2)Cl)Nc1ccc(cc1)C(=O)O

STK612898
Synonyms: 2-[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-2-yl)acetamide
Smiles: O=C(Nc1ccccn1)COc1ccc2c(c1)oc(=O)c(c2C)C

STK612899
Synonyms: N-{2-oxo-2-[({trans-4-[(pyridin-3-ylmethyl)carbamoyl]cyclohexyl}methyl)amino]ethyl}benzamide
Smiles: O=C(CNC(=O)c1ccccc1)NC[C@@H]1CC[C@H](CC1)C(=O)NCc1cccnc1

STK612903
Synonyms: N-benzyl-2-[6-(4-chlorobenzyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide
Smiles: O=C(Cc1nn2c(n1)nc(c(c2C)Cc1ccc(cc1)Cl)C)NCc1ccccc1

STK612905
Synonyms: 5-({3-[(5E)-2,4-dioxo-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]propanoyl}amino)-2-hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)C(=O)O)O)CCN1C(=O)S/C(=C/c2cccs2)/C1=O

STK612906
Synonyms: N-[7,7-dimethyl-2-(propan-2-ylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]ethane-1,2-diamine
Smiles: NCCNc1nc(SC(C)C)nc2c1sc1c2COC(C1)(C)C

STK612907
Synonyms: N-[2-ethyl-5-(quinoxalin-2-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
Smiles: CCc1ccc(cc1NC(=O)C1CN(C(=O)C1)c1ccccc1)c1cnc2c(n1)cccc2

STK612910
Synonyms: (5Z)-5-(2-fluorobenzylidene)-3-{2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoethyl}-1,3-thiazolidine-2,4-dione
Smiles: OCCC1CCCCN1C(=O)CN1C(=O)S/C(=C\c2ccccc2F)/C1=O

STK612912
Synonyms: 2-phenoxy-N-[2-([1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl]acetamide
Smiles: O=C(COc1ccccc1)NCCc1csc2n1ncn2

STK855259
Synonyms: 2-hydroxy-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}quinazolin-4(3H)-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)Cn1c(O)nc2c(c1=O)cccc2

STK612913
Synonyms: 3-[(2-hydroxyethyl)(methyl)amino]-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: OCCN(c1nc(C(C)C)c2c(c1C#N)CCCC2)C

STK612915
Synonyms: (3aS,6R)-N-[3-(dimethylamino)propyl]-2-(5-methyl-1,2-oxazol-3-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: CN(CCCNC(=O)C1[C@@H]2C=C[C@@]3(C1C(=O)N(C3)c1noc(c1)C)O2)C

STK612917
Synonyms: methylN-{[4-(ethoxycarbonyl)piperazin-1-yl]carbonyl}-L-phenylalaninate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)N[C@H](C(=O)OC)Cc1ccccc1

STK612919
Synonyms: 4-(4-hydroxyphenyl)-1-(4-methoxyphenyl)-3-methyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: COc1ccc(cc1)n1nc(c2c1N=C(O)CC2c1ccc(cc1)O)C

STK612922
Synonyms: 2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]-5-[(3-methoxybenzyl)oxy]phenol
Smiles: CCOc1ccccc1Oc1cn[nH]c1c1ccc(cc1O)OCc1cccc(c1)OC

STK612930
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-2-(3-methylphenyl)acetamide
Smiles: O=C(Cc1cccc(c1)C)NCc1cc(=O)n(c(=O)n1C)C

STK855265
Synonyms: (2Z)-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl3,5-dimethoxybenzoate
Smiles: COc1cc(OC)cc(c1)C(=O)Oc1cc2O/C(=C\c3cccnc3)/C(=O)c2c(c1)C

STK612934
Synonyms: 2-{2-[(4-tert-butylphenoxy)methyl]-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl}ethanol
Smiles: OCCn1c(C)c(c2c1ncn1c2nc(n1)COc1ccc(cc1)C(C)(C)C)C

STK612935
Synonyms: 5-{4-[(2,4-dichlorophenyl)carbonyl]piperazin-1-yl}-2-phenyl-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccc(cc1Cl)Cl)c1ccccc1

STK612941
Synonyms: 7-cycloheptyl-8,9-dimethyl-2-(pyridin-4-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c(C)n(c2c1c1nc(nn1cn2)c1ccncc1)C1CCCCCC1

STK612942
Synonyms: 2-[(4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]-N-[3-(1H-imidazol-1-yl)propyl]acetamide
Smiles: O=C(COc1cc(C)cc2c1c(C)cc(=O)o2)NCCCn1ccnc1

STK612943
Synonyms: 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]-N-[2-(morpholin-4-yl)ethyl]acetamide
Smiles: CCCCc1cc(=O)oc2c1c(OCC(=O)NCCN1CCOCC1)cc(c2)C

STK612945
Synonyms: 4-methyl-2-(4-methylphenyl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1,3-thiazole-5-carboxamide
Smiles: Cc1ccc(cc1)c1nc(c(s1)C(=O)NCCCN1CCCC1=O)C

STK612946
Synonyms: 3,5-dimethyl-N-[1-oxo-1-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)propan-2-yl]benzamide
Smiles: Cc1cc(C)cc(c1)C(=O)NC(C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1)C

STK612947
Synonyms: N-(2-chloro-6-fluorobenzyl)-2-(5-methoxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1cc(C)cc2c1c(C)c(c(=O)o2)CC(=O)NCc1c(F)cccc1Cl

STK612948
Synonyms: 3-(dimethylsulfamoyl)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide
Smiles: O=C(c1cccc(c1)S(=O)(=O)N(C)C)N[C@H](c1nnc2n1cccc2)C

STK612949
Synonyms: (7Z)-3-(3-chlorophenyl)-7-(5-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Smiles: COc1ccc2c(c1)/C(=c\1/sc3=NCN(Cn3c1=O)c1cccc(c1)Cl)/C(=O)N2

STK855267
Synonyms: N-(9-oxo-9H-xanthen-3-yl)-2-phenoxyacetamide
Smiles: O=C(Nc1ccc2c(c1)oc1c(c2=O)cccc1)COc1ccccc1

STK612952
Synonyms: 2-[(5Z)-5-(4-chlorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)acetamide
Smiles: O=C(CN1C(=O)S/C(=C\c2ccc(cc2)Cl)/C1=O)NC1C=CS(=O)(=O)C1

STK612953
Synonyms: methyl{6-[(2-pentanoylphenyl)carbonyl]-1H-benzimidazol-2-yl}carbamate
Smiles: CCCCC(=O)c1ccccc1C(=O)c1ccc2c(c1)[nH]c(n2)NC(=O)OC

STK612958
Synonyms: 5,5-dimethyl-2-{[(4-methylpiperidin-1-yl)(oxo)acetyl]amino}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxamide
Smiles: CC1CCN(CC1)C(=O)C(=O)Nc1sc2c(c1C(=O)N)CC(OC2)(C)C

STK855272
Synonyms: 2-[(4-hydroxy-6-propylpyrimidin-2-yl)sulfanyl]-N-[(2E)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]acetamide
Smiles: CCCc1nc(SCC(=O)/N=c/2\[nH]c3c(s2)cc(cc3)OC)nc(c1)O

STK612965
Synonyms: 5-(2-chlorophenyl)-4-imino-3-[2-(morpholin-4-yl)ethyl]-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: Oc1ccc2c(c1)Oc1c(C2c2ccccc2Cl)c(=N)n(cn1)CCN1CCOCC1

STK612966
Synonyms: (E)-1-(4-chlorophenyl)-N-({8,9-dimethyl-7-[2-(morpholin-4-yl)ethyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl}methoxy)methanimine
Smiles: Cc1c2c(n(c1C)CCN1CCOCC1)ncn1c2nc(n1)CO/N=C/c1ccc(cc1)Cl

STK612967
Synonyms: 6-methyl-2-(methylsulfanyl)-9-(3-methylthiophen-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)C2c1sccc1C

STK612973
Synonyms: (5Z)-5-(3-chlorobenzylidene)-3-{2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoethyl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: OCCC1CCCCN1C(=O)CN1C(=S)S/C(=C\c2cccc(c2)Cl)/C1=O

STK612974
Synonyms: (5Z)-3-(4-bromophenyl)-6-hydroxy-5-[(1,2,5-trimethyl-1H-pyrrol-3-yl)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: Brc1ccc(cc1)N1C(=O)N=C(/C(=C/c2cc(n(c2C)C)C)/C1=O)O

STK612976
Synonyms: 5-[(2,4-dichlorobenzyl)oxy]-2-[4-(2-methoxyphenoxy)-3-methyl-1H-pyrazol-5-yl]phenol
Smiles: COc1ccccc1Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1ccc(cc1Cl)Cl

STK855274
Synonyms: 2-(2-amino-5-phenylpyrimidin-4-yl)-5-[(4-methylbenzyl)oxy]phenol
Smiles: Cc1ccc(cc1)COc1ccc(c(c1)O)c1nc(N)ncc1c1ccccc1

STK612977
Synonyms: 1-(4-methoxyphenyl)-2-[(2-methylpropyl)sulfanyl]-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole5,5-dioxide
Smiles: COc1ccc(cc1)N1C(=NC2C1CS(=O)(=O)C2)SCC(C)C

STK612978
Synonyms: 1-(4-methylphenyl)-4-oxo-N-(4-phenyl-1,2,5-oxadiazol-3-yl)-1,4-dihydropyridazine-3-carboxamide
Smiles: Cc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1nonc1c1ccccc1

STK612980
Synonyms: 2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(5-methylpyridin-2-yl)acetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)Nc1ccc(cn1)C

STL036621
Synonyms: 3-[(3-fluorophenyl)amino]-1,2,4-triazin-5-ol
Smiles: Fc1cccc(c1)Nc1nncc(n1)O

STK855276
Synonyms: 2-(furan-2-yl)-5-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1cccs1)c1ccco1

STK612986
Synonyms: 1-{[(5Z)-2,4-dioxo-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]acetyl}piperidine-2-carboxylicacid
Smiles: O=C(N1CCCCC1C(=O)O)CN1C(=O)S/C(=C\c2cccs2)/C1=O

STK612992
Synonyms: N-{[3-hydroxy-2-(propan-2-yl)quinoxalin-1(2H)-yl]carbonyl}phenylalanine
Smiles: OC(=O)C(NC(=O)N1C(C(C)C)C(=Nc2c1cccc2)O)Cc1ccccc1

STK612993
Synonyms: 7-benzyl-5,6-dimethyl-3-[2-(morpholin-4-yl)ethyl]-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1c(C)n(c2c1c(=N)n(CCN1CCOCC1)cn2)Cc1ccccc1

STK612998
Synonyms: 4-{2-[4-(benzyloxy)-3-fluorophenyl]-2-oxoethyl}-2-methyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CC1Oc2ccccc2C(=O)N(C1=O)CC(=O)c1ccc(c(c1)F)OCc1ccccc1

STK612999
Synonyms: N-[(2S)-1-[(3-methoxyphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1cccc(c1)OC)NC(=O)N1CCn2c1nc1c2cccc1

STK613000
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-2-(4-methylphenyl)-1,3-thiazole-5-carboxamide
Smiles: COc1cc(CCNC(=O)c2sc(nc2C)c2ccc(cc2)C)ccc1OC

STK613004
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-methyl-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide
Smiles: S=C1S/C(=C\c2ccc(cc2)C(=O)N(C2CCS(=O)(=O)C2)C)/C(=O)N1C

STK613006
Synonyms: 2-(2-methoxyphenyl)-8,9-dimethyl-7-(pyridin-3-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1c1nc2n(n1)cnc1c2c(C)c(n1c1cccnc1)C

STK613007
Synonyms: 5-[(3-methylphenoxy)methyl]-N-[3-(1H-tetrazol-1-yl)phenyl]furan-2-carboxamide
Smiles: Cc1cccc(c1)OCc1ccc(o1)C(=O)Nc1cccc(c1)n1cnnn1

STK613010
Synonyms: N-[3-(cyclopropylamino)-3-oxopropyl]-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: O=C(NC1CC1)CCNC(=O)N1CC(=Nc2c1cccc2)O

STK613012
Synonyms: ethyl5-(2-methylpropyl)-1-[(morpholin-4-ylacetyl)amino]-6,7,8,9-tetrahydrofuro[2,3-c]isoquinoline-2-carboxylate
Smiles: CCOC(=O)c1oc2c(c1NC(=O)CN1CCOCC1)c1CCCCc1c(n2)CC(C)C

STK613013
Synonyms: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-6-(2-methylpiperidin-1-yl)pyrimidine
Smiles: CC1CCCCN1c1nc(nc(c1Br)C)n1nc(cc1C)C

STK613015
Synonyms: 1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-(6-nitro-1H-benzimidazol-2-yl)propan-1-one
Smiles: O=C(N1CCc2c(C1)cccc2)CCc1nc2c([nH]1)cc(cc2)[N+](=O)[O-]

STK613017
Synonyms: 5-(furan-2-yl)-3-[3-(1H-imidazol-1-yl)propyl]-4-imino-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: Oc1ccc2c(c1)Oc1c(C2c2ccco2)c(=N)n(cn1)CCCn1ccnc1

STK613018
Synonyms: 2-{[3-(2,4-dichlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl](methyl)amino}ethanol
Smiles: OCCN(c1ccc2n(n1)c(nn2)c1ccc(cc1Cl)Cl)C

STK613019
Synonyms: N-(furan-2-ylmethyl)-3-methyl-5-(phenylcarbonyl)imidazo[2,1-b][1,3]thiazole-2-carboxamide
Smiles: O=C(c1sc2n(c1C)c(cn2)C(=O)c1ccccc1)NCc1ccco1

STK613021
Synonyms: 5-[(3-chlorobenzyl)oxy]-2-[5-(2-methoxyphenyl)pyrimidin-4-yl]phenol
Smiles: COc1ccccc1c1cncnc1c1ccc(cc1O)OCc1cccc(c1)Cl

STK613022
Synonyms: 2-[(2R)-3-methyl-1-(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)-1-oxobutan-2-yl]-1H-isoindole-1,3(2H)-dione
Smiles: CC(C(N1C(=O)c2c(C1=O)cccc2)C(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1)C

STL036622
Synonyms: ethyl4-[(5-hydroxy-6-methyl-1,2,4-triazin-3-yl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nnc(c(n1)O)C

STK855283
Synonyms: methyl2-[({5-chloro-2-[(2-methylbenzyl)sulfanyl]pyrimidin-4-yl}carbonyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)c1nc(ncc1Cl)SCc1ccccc1C

STK613027
Synonyms: 2-{4-[4-cyano-1-(2-methylpropyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl]piperazin-1-yl}-N-(2-methoxyphenyl)acetamide
Smiles: N#Cc1c(nc(c2c1CCC2)CC(C)C)N1CCN(CC1)CC(=O)Nc1ccccc1OC

STK613029
Synonyms: (2-{[(2Z)-5,5-dioxido-3-[4-(propan-2-yl)phenyl]tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-2-oxoethoxy)aceticacid
Smiles: OC(=O)COCC(=O)/N=C/1\SC2C(N1c1ccc(cc1)C(C)C)CS(=O)(=O)C2

STK613030
Synonyms: N-{4-[5-(4-fluorophenyl)-1-(furan-2-ylcarbonyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}ethanesulfonamide
Smiles: CCS(=O)(=O)Nc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)F)C(=O)c1ccco1

STK613033
Synonyms: 2-[4-(4-methoxyphenyl)-3-methyl-1H-pyrazol-5-yl]-5-[2-(4-methylpiperidin-1-yl)ethoxy]phenol
Smiles: COc1ccc(cc1)c1c(C)n[nH]c1c1ccc(cc1O)OCCN1CCC(CC1)C

STK855285
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-2,3-dimethyl-1H-indole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)NCc1ccc2c(c1)OCO2

STK613035
Synonyms: 6-chloro-3-(4-chlorophenyl)-2-methyl-5-propylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: CCCc1nc2c(c3ccc(cc3)Cl)c(nn2c(c1Cl)O)C

STK613038
Synonyms: 2-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N'-[(naphthalen-1-yloxy)acetyl]acetohydrazide
Smiles: O=C(COc1cccc2c1cccc2)NNC(=O)Cc1nn2c(n1)nc(cc2C)C

STK613041
Synonyms: 5,6-dimethyl-3-(2-methylpropyl)-7-[2-(morpholin-4-yl)ethyl]-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: CC(Cn1cnc2c(c1=N)c(C)c(n2CCN1CCOCC1)C)C

STK613042
Synonyms: 3-{[(E)-(5-bromo-2-hydroxy-3-methylphenyl)methylidene]amino}-2-hydroxyquinazolin-4(3H)-one
Smiles: Brc1cc(/C=N/n2c(O)nc3c(c2=O)cccc3)c(c(c1)C)O

STK613044
Synonyms: ethyl2-[(phenylcarbonyl)amino]-4,5-dihydronaphtho[1,2-b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1CCc1c2cccc1

STK613045
Synonyms: 2-hydroxy-1-(2-phenylethyl)-6-(pyridin-3-ylmethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(O)n(c2c1CN(CN2)Cc1cccnc1)CCc1ccccc1

STK613046
Synonyms: 4-chloro-N-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)nc(n2C)CCn1nc(cc1C)C

STK613048
Synonyms: 3,7,7-trimethyl-1-propyl-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Smiles: CCCn1c2c3COC(Cc3sc2c(=O)n(c1=O)C)(C)C

STK613049
Synonyms: 2,2-bis(4-chlorophenyl)-N-(propan-2-yl)cyclopropanecarboxamide
Smiles: CC(NC(=O)C1CC1(c1ccc(cc1)Cl)c1ccc(cc1)Cl)C

STK613051
Synonyms: N-(2,4-dimethoxybenzyl)-2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1ccc(c(c1)OC)CNC(=O)Cc1c(=O)oc2c(c1C)ccc(c2OC)OC

STK855286
Synonyms: 4-methoxy-N-methyl-N-[1-(2-methylpropyl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]benzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)N(c1nc2ccccc2n2c1nnc2CC(C)C)C

STK855287
Synonyms: 1-(4-bromophenyl)-5-{[(4-methylphenyl)sulfonyl]methyl}-1H-tetrazole
Smiles: Cc1ccc(cc1)S(=O)(=O)Cc1nnnn1c1ccc(cc1)Br

STK613054
Synonyms: 2-{[bis(2-hydroxyethyl)carbamoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylicacid
Smiles: OCCN(C(=O)Nc1sc2c(c1C(=O)O)CCC2)CCO

STK613057
Synonyms: 3,5-dimethyl-N-[2-([1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl]-1,2-oxazole-4-sulfonamide
Smiles: Cc1onc(c1S(=O)(=O)NCCc1csc2n1ncn2)C

STK613058
Synonyms: N-[2-([1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl]thiophene-2-sulfonamide
Smiles: O=S(=O)(c1cccs1)NCCc1csc2n1ncn2

STK613061
Synonyms: 2-[(5Z)-5-(2-fluorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]acetamide
Smiles: OCC(NC(=O)CN1C(=O)S/C(=C\c2ccccc2F)/C1=O)Cc1ccccc1

STK613062
Synonyms: N-(3-acetylphenyl)-2-(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)Nc1cccc(c1)C(=O)C

STK613068
Synonyms: 2-{[4-cyano-1-(morpholin-4-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cccc(c2)C)nc(c2c1CCCC2)N1CCOCC1

STK613071
Synonyms: 7-hydroxy-8-{[(2-methoxyphenyl)amino]methyl}-3,4-dimethyl-2H-chromen-2-one
Smiles: COc1ccccc1NCc1c(O)ccc2c1oc(=O)c(c2C)C

STK855288
Synonyms: 2-[5-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-ethoxyphenol
Smiles: CCOc1ccc(c(c1)O)c1ncnc(c1c1ccc(c(c1)OC)OC)C(F)(F)F

STK613076
Synonyms: 1-(2-chlorobenzyl)-N-(pyridin-3-ylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Smiles: Clc1ccccc1Cn1ncc2c1ncnc2NCc1cccnc1

STK613077
Synonyms: (E)-1-(4-chlorophenyl)-N-[(8,9-dimethyl-7-phenyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]methanimine
Smiles: Clc1ccc(cc1)/C=N/OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1ccccc1

STK613078
Synonyms: 4-phenyl-5-[4-(propan-2-yloxy)phenyl]-4H-1,2,4-triazole-3-thiol
Smiles: CC(Oc1ccc(cc1)c1nnc(n1c1ccccc1)S)C

STK613079
Synonyms: N-[6-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)hexanoyl]glycine
Smiles: O=C(NCC(=O)O)CCCCCn1c(O)nc2c(c1=O)cccc2

STK855291
Synonyms: 3-(4-bromophenyl)-7-[2-(morpholin-4-yl)ethoxy]-4H-chromen-4-one
Smiles: Brc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCCN1CCOCC1

STK855292
Synonyms: 2-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]-5-[2-(morpholin-4-yl)ethoxy]phenol
Smiles: COc1ccc(cc1)c1cn[nH]c1c1ccc(cc1O)OCCN1CCOCC1

STK855293
Synonyms: 2-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl]pyridine
Smiles: FC(c1cccc(c1)n1nnnc1CSc1ccccn1)(F)F

STK613088
Synonyms: 2-hydroxy-6-(1-phenylethyl)-1-(pyridin-3-ylmethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CC(N1CNc2c(C1)c(=O)nc(n2Cc1cccnc1)O)c1ccccc1

STK855294
Synonyms: 3-(pyrazin-2-yl)-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: c1cnc(cn1)c1nnc2n1nc(s2)C12CC3CC(C2)CC(C1)C3

STK613092
Synonyms: 3-[7-chloro-4-(2-methylpropyl)-3-oxo-3,4-dihydroquinoxalin-2-yl]-N-(2,3-dihydro-1H-inden-5-yl)propanamide
Smiles: CC(Cn1c(=O)c(CCC(=O)Nc2ccc3c(c2)CCC3)nc2c1ccc(c2)Cl)C

STK855295
Synonyms: 3,3'-[(2,5-dimethoxyphenyl)methanediyl]bis(4-hydroxy-1,6-dimethylpyridin-2(1H)-one)
Smiles: COc1ccc(cc1C(c1c(O)cc(n(c1=O)C)C)c1c(O)cc(n(c1=O)C)C)OC

STK613099
Synonyms: 2-hydroxy-5-{(5Z)-5-[(5-methoxy-1H-indol-3-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzoicacid
Smiles: COc1ccc2c(c1)c(c[nH]2)/C=C/1\SC(=S)N(C1=O)c1ccc(c(c1)C(=O)O)O

STK613100
Synonyms: 2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-8,9-dimethyl-7-(pyridin-4-ylmethyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c(C)c2c(n1Cc1ccncc1)ncn1c2nc(n1)CSc1nc2c(o1)cccc2

STK855296
Synonyms: 5-(3-bromophenyl)-7-(4-methoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1)C1CC(Nc2n1nnn2)c1cccc(c1)Br

STK613110
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)N1CCc2c(C1c1ccc(cc1)F)cc(c(c2)OC)OC)C

STK613111
Synonyms: 2-[(4-butyl-2-oxo-2H-chromen-7-yl)oxy]-N-(4-sulfamoylbenzyl)acetamide
Smiles: CCCCc1cc(=O)oc2c1ccc(c2)OCC(=O)NCc1ccc(cc1)S(=O)(=O)N

STK613113
Synonyms: N-(1-benzylpiperidin-4-yl)-2-[(4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]acetamide
Smiles: O=C(NC1CCN(CC1)Cc1ccccc1)COc1cc(C)cc2c1c(C)cc(=O)o2

STK613114
Synonyms: 2-({[2-(morpholin-4-yl)ethyl]carbamoyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Smiles: O=C(Nc1sc2c(c1C(=O)N)CCC2)NCCN1CCOCC1

STK855297
Synonyms: 8-methyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxo-4H-chromen-7-yl2-chlorobenzoate
Smiles: Cc1csc(n1)c1coc2c(c1=O)ccc(c2C)OC(=O)c1ccccc1Cl

STK855298
Synonyms: 2-{[3-(2-methoxyphenyl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetamide
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)N

STK613117
Synonyms: 1-(2-{[3-(4-bromophenyl)-4-oxo-4H-chromen-7-yl]oxy}ethyl)piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)CCOc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Br

STK613119
Synonyms: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-6-(piperidin-1-yl)pyrimidine
Smiles: Cc1nn(c(c1)C)c1nc(N2CCCCC2)c(c(n1)C)Br

STK613120
Synonyms: 4-[3-(4-chlorophenyl)-3-(4-fluorophenyl)propyl]morpholine
Smiles: Fc1ccc(cc1)C(c1ccc(cc1)Cl)CCN1CCOCC1

STK613124
Synonyms: 2-[2-(3,4-dimethoxybenzyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl]ethanol
Smiles: OCCn1c(C)c(c2c1ncn1c2nc(n1)Cc1ccc(c(c1)OC)OC)C

STK613126
Synonyms: 2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(pyridin-2-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)Nc1ccccn1

STK613129
Synonyms: (2E)-3-phenyl-1-(3-phenyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)prop-2-en-1-one
Smiles: O=C(N1CCc2c(C1)c(n[nH]2)c1ccccc1)/C=C/c1ccccc1

STK613131
Synonyms: 3-(4-methoxyphenyl)-7-[(3-methoxyphenyl)amino]-2-methyl-4H-chromen-4-one
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)Nc1cccc(c1)OC

STK855300
Synonyms: 2-(1H-benzimidazol-2-yl)-4-butyl-5-methyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CCCCc1c(C)[nH]n(c1=O)c1nc2c([nH]1)cccc2

STK613135
Synonyms: 2-[2-(2-bromophenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl]-N,N-dimethylethanamine
Smiles: CN(CCn1c(C)c(c2c1ncn1c2nc(n1)c1ccccc1Br)C)C

STK613136
Synonyms: (2Z)-6-methyl-2-[(5-methylthiophen-2-yl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Smiles: Cc1ccc(s1)/C=c/1\sc2n(c1=O)nc(c(=O)n2)C

STK613138
Synonyms: 2-(2-methoxyphenyl)-8,9-dimethyl-7-[3-(morpholin-4-yl)propyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1c1nc2n(n1)cnc1c2c(C)c(n1CCCN1CCOCC1)C

STK613140
Synonyms: (5Z)-1-(2-fluorophenyl)-2-sulfanyl-5-(2,3,4-trimethoxybenzylidene)pyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccc(c(c1OC)OC)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1F)S

STK613142
Synonyms: (E)-1-(2-chlorophenyl)-N-({8,9-dimethyl-7-[2-(morpholin-4-yl)ethyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl}methoxy)methanimine
Smiles: Clc1ccccc1/C=N/OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)CCN1CCOCC1

STK613143
Synonyms: 2-hydroxy-4-[({(5Z)-4-oxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-2-thioxo-1,3-thiazolidin-3-yl}acetyl)amino]benzoicacid
Smiles: O=C(CN1C(=S)S/C(=C\C=C\c2ccccc2)/C1=O)Nc1ccc(c(c1)O)C(=O)O

STK613145
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-2-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: CCN(C1CCS(=O)(=O)C1)C(=O)CN1C(=S)S/C(=C\c2ccc(cc2)F)/C1=O

STK613151
Synonyms: 3-({4-[(E)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]phenoxy}methyl)benzoicacid
Smiles: OC1=NC(=O)/C(=C/c2ccc(cc2)OCc2cccc(c2)C(=O)O)/C(=N1)O

STK613155
Synonyms: 2-[(2-oxo-2H-chromen-7-yl)oxy]-N-(4-sulfamoylbenzyl)propanamide
Smiles: O=c1ccc2c(o1)cc(cc2)OC(C(=O)NCc1ccc(cc1)S(=O)(=O)N)C

STK613158
Synonyms: 1-(2-methylpropyl)-3-(morpholin-4-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(nc(c2c1CCCC2)CC(C)C)N1CCOCC1

STK613160
Synonyms: (4Z)-4-[2-(benzyloxy)-5-chlorobenzylidene]-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(c(c1)/C=C\1/C(=NN(C1=O)c1ccccc1)O)OCc1ccccc1

STK613167
Synonyms: 5-ethyl-N-[(2S)-3-methyl-1-oxo-1-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}butan-2-yl]-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: CCn1cc(C(=O)N[C@H](C(=O)NCCCN2CCCC2=O)C(C)C)c(=O)c2c1cc1OCOc1c2

STK613169
Synonyms: furan-2-yl[4-(4-hydroxy-6-methylpyrimidin-2-yl)piperazin-1-yl]methanone
Smiles: Cc1cc(O)nc(n1)N1CCN(CC1)C(=O)c1ccco1

STK613171
Synonyms: 1-(2-fluorophenyl)-2-hydroxypyrimidine-4,6(1H,5H)-dione
Smiles: O=C1CC(=O)N(C(=N1)O)c1ccccc1F

STK613172
Synonyms: 3-[3-(1H-imidazol-1-yl)propyl]-5,6-dimethyl-7-(pyridin-3-yl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1c(C)n(c2c1c(=N)n(CCCn1cncc1)cn2)c1cccnc1

STK613176
Synonyms: 2-[(5Z)-5-(4-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)propanamide
Smiles: O=C(C(N1C(=S)S/C(=C\c2ccc(cc2)Cl)/C1=O)C)NC1C=CS(=O)(=O)C1

STK613179
Synonyms: 6-methoxy-1-(pyridin-4-yl)-2-(1,3-thiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)c1nccs1)c1ccncc1

STK613180
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-ethyl-5-methyl-7-oxo-2-thioxo-3,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-6(2H)-yl)acetamide
Smiles: COc1cc(CCNC(=O)Cn2c(C)nc3c(c2=O)sc(=S)n3CC)ccc1OC

STK613184
Synonyms: 2-[2-amino-5-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-[(4-methylbenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1c(nc(nc1C(F)(F)F)N)c1ccc(cc1O)OCc1ccc(cc1)C

STK613185
Synonyms: 1-amino-4-{[3-(dimethylamino)propyl]amino}-2-[(2-hydroxyethyl)amino]anthracene-9,10-dione
Smiles: OCCNc1cc(NCCCN(C)C)c2c(c1N)C(=O)c1c(C2=O)cccc1

STK613188
Synonyms: 2-[2-amino-5-(2-ethoxyphenoxy)pyrimidin-4-yl]-5-[(2-chloro-4-fluorobenzyl)oxy]phenol
Smiles: CCOc1ccccc1Oc1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1Cl)F)N

STK855307
Synonyms: 2-(4,6-dimethylpyrimidin-2-yl)-5-(4-fluorophenyl)-1,2-dihydro-3H-pyrazol-3-one
Smiles: Fc1ccc(cc1)c1[nH]n(c(=O)c1)c1nc(C)cc(n1)C

STK613190
Synonyms: 1-(2-chlorobenzyl)-4-(4-cyclohexylpiperazin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Clc1ccccc1Cn1ncc2c1ncnc2N1CCN(CC1)C1CCCCC1

STK613191
Synonyms: 7-(4-acetylpiperazin-1-yl)-1-cyclopropyl-6-fluoro-N-(3-hydroxypropyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: OCCCNC(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)C)F

STK855310
Synonyms: 2-[2-amino-5-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-[(2-methylprop-2-en-1-yl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1c(nc(nc1C(F)(F)F)N)c1ccc(cc1O)OCC(=C)C

STK613196
Synonyms: 3-chloro-N-[4-(4-fluorophenyl)-1,2,5-oxadiazol-3-yl]-1-benzothiophene-2-carboxamide
Smiles: Fc1ccc(cc1)c1nonc1NC(=O)c1sc2c(c1Cl)cccc2

STK855311
Synonyms: (2Z)-2-(4-fluorobenzylidene)-6-methoxy-4-methyl-1-benzofuran-3(2H)-one
Smiles: COc1cc2O/C(=C\c3ccc(cc3)F)/C(=O)c2c(c1)C

STK613199
Synonyms: 2-({[(2-aminoethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylicacid
Smiles: NCCNC(=O)C(=O)Nc1sc2c(c1C(=O)O)CC(OC2)(C)C

STK855312
Synonyms: 4,11,11-trimethyl-N-(pyridin-3-yl)-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(c2c1nc1ccccc1n2)C)Nc1cccnc1

STK613200
Synonyms: 4-hydroxy-2-methyl-5-[4-(2-phenylethoxy)phenyl]-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C1Nc2nc(C)nc(c2C(C1)c1ccc(cc1)OCCc1ccccc1)O

STK855313
Synonyms: 4-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: COc1ccc(cc1C(=O)CN1C(=O)COc2c(C1=O)cccc2)C

STK613204
Synonyms: 2-({[(3-methylbutyl)amino](oxo)acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylicacid
Smiles: CC(CCNC(=O)C(=O)Nc1sc2c(c1C(=O)O)CCCC2)C

STK855314
Synonyms: 5-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-phenyl-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccco1)c1ccccc1

STK613207
Synonyms: N-(1H-benzimidazol-2-yl)-3-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: O=C(Nc1nc2c([nH]1)cccc2)CCn1c(O)nc2c(c1=O)cccc2

STK855315
Synonyms: N-benzyl-4,7,7-trimethyl-3-oxo-N-(pyridin-2-yl)-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)N(c1ccccn1)Cc1ccccc1

STK613209
Synonyms: 2-[(6-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(2-hydroxy-2-phenylethyl)propanamide
Smiles: O=C(C(Oc1cc2oc(=O)cc(c2cc1Cl)C)C)NCC(c1ccccc1)O

STK855317
Synonyms: N-{4-[1-acetyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl}methanesulfonamide
Smiles: COc1cc(ccc1OC)C1CC(=NN1C(=O)C)c1ccc(cc1)NS(=O)(=O)C

STK613211
Synonyms: (1Z)-N-[(7-benzyl-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]-1-(3,4-dimethoxyphenyl)ethanimine
Smiles: COc1cc(ccc1OC)/C(=N\OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)Cc1ccccc1)/C

STK613212
Synonyms: (2S)-N-(4-chlorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: O=C([C@@H](n1c(O)nc2c(c1=O)cccc2)C)Nc1ccc(cc1)Cl

STK613213
Synonyms: 2-{[(2-hydroxypropyl)carbamoyl]amino}-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxamide
Smiles: CC(CNC(=O)Nc1sc2c(c1C(=O)N)CC(OC2)(C)C)O

STK613215
Synonyms: methyl4-(4-hydroxy-3-methoxyphenyl)-2-methyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)O)c1ccccc1[nH]2

STK613216
Synonyms: methylN-{[6,7-dimethoxy-1-(4-methoxyphenyl)-3,4-dihydroisoquinolin-2(1H)-yl]carbonyl}-beta-alaninate
Smiles: COC(=O)CCNC(=O)N1CCc2c(C1c1ccc(cc1)OC)cc(c(c2)OC)OC

STK613220
Synonyms: 5-(benzyloxy)-2-[4-(3,4-dimethoxyphenyl)-3-methyl-1H-pyrazol-5-yl]phenol
Smiles: COc1cc(ccc1OC)c1c(C)n[nH]c1c1ccc(cc1O)OCc1ccccc1

STK855319
Synonyms: methyl2-{[ethoxy(oxo)acetyl]amino}-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: CCOC(=O)C(=O)Nc1sc2c(c1C(=O)OC)CC(OC2)(C)C

STK613224
Synonyms: 4-chloro-N-[2-(1H-imidazol-1-ylmethyl)-1-(2-methylpropyl)-1H-benzimidazol-5-yl]benzenesulfonamide
Smiles: CC(Cn1c(Cn2cncc2)nc2c1ccc(c2)NS(=O)(=O)c1ccc(cc1)Cl)C

STK855320
Synonyms: 6-chloro-4-[(2,6-dimethylmorpholin-4-yl)methyl]-7-hydroxy-2H-chromen-2-one
Smiles: CC1CN(CC(O1)C)Cc1cc(=O)oc2c1cc(Cl)c(c2)O

STK613227
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-2-(4-fluorophenyl)acetamide
Smiles: O=C(Cc1ccc(cc1)F)NCc1cc(=O)n(c(=O)n1C)C

STK855321
Synonyms: 2-[3-(furan-2-yl)-1H-pyrazol-5-yl]-8,9-dimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1sc2c(c1C)c1nc(nn1cn2)c1[nH]nc(c1)c1ccco1

STK613230
Synonyms: 7-[3-(dimethylamino)propyl]-5,6-dimethyl-N-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: CN(CCCn1c(C)c(c2c1ncnc2Nc1ccccc1)C)C

STK613232
Synonyms: N-butyl-5,6-di(furan-2-yl)furo[2,3-d]pyrimidin-4-amine
Smiles: CCCCNc1ncnc2c1c(c1ccco1)c(o2)c1ccco1

STK613236
Synonyms: 2-[2-amino-5-(3-methoxyphenoxy)pyrimidin-4-yl]-5-[(4-ethenylbenzyl)oxy]phenol
Smiles: C=Cc1ccc(cc1)COc1ccc(c(c1)O)c1nc(N)ncc1Oc1cccc(c1)OC

STK855323
Synonyms: 2-{[4-(3-chlorophenyl)piperazin-1-yl]carbonyl}-5,7-dimethyl-4H-chromen-4-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)c1cc(=O)c2c(o1)cc(cc2C)C

STK613239
Synonyms: 3-(3,4-dimethoxyphenyl)-2-methyl-7-[2-(piperidin-1-yl)ethoxy]-4H-chromen-4-one
Smiles: COc1cc(ccc1OC)c1c(C)oc2c(c1=O)ccc(c2)OCCN1CCCCC1

STK613241
Synonyms: 2-{4-[1-(4-fluorophenyl)-6-hydroxy-3-methyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy}acetamide
Smiles: NC(=O)COc1ccc(cc1)C1CC(=Nc2c1c(C)nn2c1ccc(cc1)F)O

STK613242
Synonyms: 5-(2,4-dichlorophenyl)-4-hydroxy-2-methyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C1Nc2nc(C)nc(c2C(C1)c1ccc(cc1Cl)Cl)O

STK613245
Synonyms: methyl2-[(hydrazinylcarbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: NNC(=O)Nc1sc2c(c1C(=O)OC)CCC2

STK613248
Synonyms: N-[3-(dimethylamino)propyl]-2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]propanamide
Smiles: CN(CCCNC(=O)C(Oc1cc(C)cc2c1c(C)c(c(=O)o2)C)C)C

STK613249
Synonyms: N-[(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)(methyl)carbamothioyl]benzamide
Smiles: N#Cc1c(sc2c1CC(C)(C)OC2)N(C(=S)NC(=O)c1ccccc1)C

STK613250
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-3-methoxybenzamide
Smiles: COc1cccc(c1)C(=O)NCc1cc(=O)n(c(=O)n1C)C

STK855324
Synonyms: 3-methyl-2-[(5-methyl-2-oxo-1-propyl-2,3-dihydro-1H-indol-3-yl)methyl]quinazolin-4(3H)-one
Smiles: CCCN1C(=O)C(c2c1ccc(c2)C)Cc1nc2ccccc2c(=O)n1C

STK855325
Synonyms: 2-(3-chlorophenyl)-5-{4-[(4-chlorophenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccc(cc1)Cl)c1cccc(c1)Cl

STK613255
Synonyms: 2-amino-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Nc1nn2c(n1)nc(cc2O)c1ccccc1

STK613260
Synonyms: N-[(4E)-2-(3,4-dimethoxyphenyl)-4H-chromen-4-ylidene]-5-methyl-4-(thiophen-2-yl)-1,3-thiazol-2-amine
Smiles: COc1cc(ccc1OC)c1c/c(=N\c2sc(c(n2)c2cccs2)C)/c2c(o1)cccc2

STK613262
Synonyms: 2-{[4-cyano-1-(pyrrolidin-1-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}-N-methyl-N-phenylacetamide
Smiles: N#Cc1c(SCC(=O)N(c2ccccc2)C)nc(c2c1CCCC2)N1CCCC1

STK613263
Synonyms: [7-methyl-2,4-dioxo-1-(2-phenylethyl)-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl]aceticacid
Smiles: CC1CCc2c(C1)sc1c2c(=O)n(c(=O)n1CCc1ccccc1)CC(=O)O

STK613264
Synonyms: (3R)-4-{[(trans-4-{[(tert-butoxycarbonyl)amino]methyl}cyclohexyl)carbonyl]amino}-3-(4-chlorophenyl)butanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)Cl)CNC(=O)[C@@H]1CC[C@H](CC1)CNC(=O)OC(C)(C)C

STK613267
Synonyms: 2-[(4-chloro-3-methylphenoxy)methyl]-5-[(pyridin-4-ylmethyl)amino]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NCc1ccncc1)COc1ccc(c(c1)C)Cl

STK613270
Synonyms: N-[4-(methylsulfanyl)-1-oxo-1-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)butan-2-yl]furan-2-carboxamide
Smiles: CSCCC(C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1)NC(=O)c1ccco1

STK613274
Synonyms: (2E)-3-(1,3-benzodioxol-5-yl)-N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]prop-2-enamide
Smiles: O=C(NCc1cc(=O)n(c(=O)n1C)C)/C=C/c1ccc2c(c1)OCO2

STK613279
Synonyms: 3-[(4-{(E)-[1-(2-fluorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}phenoxy)methyl]benzoicacid
Smiles: O=C1N=C(O)/C(=C\c2ccc(cc2)OCc2cccc(c2)C(=O)O)/C(=O)N1c1ccccc1F

STK613280
Synonyms: 1-propyl-3-[(pyridin-2-ylmethyl)amino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: CCCc1nc(NCc2ccccn2)c(c2c1CCCC2)C#N

STK613281
Synonyms: 6-ethyl-5-methyl-2,3-diphenylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: CCc1c(C)nc2n(c1O)nc(c2c1ccccc1)c1ccccc1

STK613282
Synonyms: (2E)-4-[5'-(4-methoxyphenyl)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrazol]-2'(4'H)-yl]-4-oxobut-2-enoicacid
Smiles: COc1ccc(cc1)C1=NN(C2(C1)C(=O)Nc1c2cccc1)C(=O)/C=C/C(=O)O

STK855326
Synonyms: (2Z)-4-methyl-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl4-methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1cc(C)c2c(c1)O/C(=C\c1ccncc1)/C2=O

STK613288
Synonyms: (4E)-1-[2-(diethylamino)ethyl]-4-[furan-2-yl(hydroxy)methylidene]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: CCN(CCN1C(c2ccccn2)/C(=C(/c2ccco2)\O)/C(=O)C1=O)CC

STK613289
Synonyms: 1-(9H-purin-6-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1ncnc2c1nc[nH]2)NC1CC(C)(C)NC(C1)(C)C

STK855328
Synonyms: 5-{4-[(4-fluorophenyl)carbonyl]piperazin-1-yl}-2-(2-methoxyphenyl)-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccc(cc1)F)c1ccccc1OC

STK613294
Synonyms: 2-[(4-chlorophenoxy)methyl]-8,9-dimethyl-7-[3-(morpholin-4-yl)propyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)CCCN1CCOCC1

STK855329
Synonyms: 1,3,7-trimethyl-8-(1-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc1n2cc(n1C(c1ccccc1)C)C

STK613296
Synonyms: 5-(2-fluorophenyl)-4-hydroxy-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C1Nc2nc(nc(c2C(C1)c1ccccc1F)O)c1ccccc1

STK613297
Synonyms: (2,6-dichloro-4-{(Z)-[1-(3,5-dimethylphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}phenoxy)aceticacid
Smiles: OC(=O)COc1c(Cl)cc(cc1Cl)/C=C\1/C(=NC(=O)N(C1=O)c1cc(C)cc(c1)C)O

STK613299
Synonyms: 2-{8,9-dimethyl-2-[({[(E)-phenylmethylidene]amino}oxy)methyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl}-N,N-dimethylethanamine
Smiles: CN(CCn1c(C)c(c2c1ncn1c2nc(n1)CO/N=C/c1ccccc1)C)C

STK613300
Synonyms: (5Z)-2,6-dihydroxy-5-(pyridin-2-ylmethylidene)pyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C\c2ccccn2)/C(=N1)O

STK613303
Synonyms: 2-(furan-2-yl)-8,9-dimethyl-7-(1,3-thiazol-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c(C)n(c2c1c1nc(nn1cn2)c1ccco1)c1nccs1

STK613309
Synonyms: 2-[4-(3,4-dimethoxyphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]-5-[(4-nitrobenzyl)oxy]phenol
Smiles: COc1ccc(cc1OC)c1c([nH]nc1C(F)(F)F)c1ccc(cc1O)OCc1ccc(cc1)[N+](=O)[O-]

STK613310
Synonyms: (5Z)-3-{3-[2-(2-hydroxyethyl)piperidin-1-yl]-3-oxopropyl}-5-(4-methoxybenzylidene)-1,3-thiazolidine-2,4-dione
Smiles: OCCC1CCCCN1C(=O)CCN1C(=O)S/C(=C\c2ccc(cc2)OC)/C1=O

STK613311
Synonyms: (2-{[(2Z)-3-(4-chlorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-2-oxoethoxy)aceticacid
Smiles: OC(=O)COCC(=O)/N=C/1\SC2C(N1Cc1ccc(cc1)Cl)CS(=O)(=O)C2

STK613312
Synonyms: 5-{[3-(diethylamino)propyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile
Smiles: CCN(CCCNc1oc(nc1C#N)c1ccc(cc1)[N+](=O)[O-])CC

STK855330
Synonyms: 3-[(4-ethoxyphenyl)amino]-1,2,4-triazin-5-ol
Smiles: CCOc1ccc(cc1)Nc1nncc(n1)O

STK613316
Synonyms: N-[4-(2-hydroxyethyl)phenyl]-2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetamide
Smiles: OCCc1ccc(cc1)NC(=O)COc1cc(C)cc2c1c(C)c(c(=O)o2)C

STK613317
Synonyms: 5,6-dimethyl-N-[2-(morpholin-4-yl)ethyl]-7-(pyridin-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: Cc1c2c(NCCN3CCOCC3)ncnc2n(c1C)c1ccncc1

STK613318
Synonyms: N-[(3R)-3-(4-chlorophenyl)-4-{[(3S)-1,2,3,4-tetrahydroisoquinolin-3-ylcarbonyl]amino}butanoyl]-D-alanine
Smiles: O=C(CC(c1ccc(cc1)Cl)CNC(=O)[C@H]1NCc2c(C1)cccc2)N[C@@H](C(=O)O)C

STK613319
Synonyms: 5,6-dimethyl-7-(2-methylpropyl)-N-(1,3-thiazol-2-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: CC(Cn1c(C)c(c2c1ncnc2Nc1nccs1)C)C

STK613320
Synonyms: (4E)-4-[furan-2-yl(hydroxy)methylidene]-1-[2-(morpholin-4-yl)ethyl]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccco2)/O)/C(N1CCN1CCOCC1)c1ccccn1

STK613322
Synonyms: 2-methyl-5-(naphthalen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1nn2c(n1)nc(cc2O)c1ccc2c(c1)cccc2

STK613323
Synonyms: 2-hydroxy-3-{[4-(morpholin-4-ylcarbonyl)cyclohexyl]methyl}quinazolin-4(3H)-one
Smiles: O=C(N1CCOCC1)C1CCC(CC1)Cn1c(O)nc2c(c1=O)cccc2

STK613325
Synonyms: 6-chloro-3,4-dimethyl-9-(pyridin-3-yl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: Clc1cc2c(c3c1OCN(C3)c1cccnc1)oc(=O)c(c2C)C

STK613328
Synonyms: 2,3-dimethyl-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-1H-indole-5-carboxamide
Smiles: Cc1n[nH]/c(=N/C(=O)c2ccc3c(c2)c(C)c([nH]3)C)/s1

STK613335
Synonyms: 2-[(4-chloro-3-methylphenoxy)methyl]-5-[(1,1-dioxidotetrahydrothiophen-3-yl)amino]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NC1CCS(=O)(=O)C1)COc1ccc(c(c1)C)Cl

STK613339
Synonyms: 3-[2-(3,4-dimethoxyphenyl)ethyl]-7-(furan-2-ylmethyl)-5,6-dimethyl-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: COc1cc(ccc1OC)CCn1cnc2c(c1=N)c(C)c(n2Cc1ccco1)C

STK613340
Synonyms: (2,4-difluorophenyl)(5-methylidene-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-6(5H)-yl)methanone
Smiles: Fc1ccc(c(c1)F)C(=O)N1CCc2c(C1=C)cc1c(c2)OCO1

STK613342
Synonyms: 3-(4-methoxyphenyl)-N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]propanamide
Smiles: COc1ccc(cc1)CCC(=O)NCc1noc(n1)c1ccccc1

STK613347
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-5-(phenylcarbonyl)imidazo[2,1-b][1,3]thiazole-2-carboxamide
Smiles: O=C(c1sc2n(c1C)c(cn2)C(=O)c1ccccc1)NCc1ccc2c(c1)OCO2

STK613351
Synonyms: N-(1,3-benzothiazol-2-yl)-3,6-dichloropyridine-2-carboxamide
Smiles: Clc1ccc(c(n1)C(=O)Nc1nc2c(s1)cccc2)Cl

STK613355
Synonyms: 2-methyl-N-[(2E)-5-[(2-methylbenzyl)sulfonyl]-1,3,4-thiadiazol-2(3H)-ylidene]propanamide
Smiles: O=C(C(C)C)/N=c/1\[nH]nc(s1)S(=O)(=O)Cc1ccccc1C

STK613356
Synonyms: 7-(2-methoxyphenyl)-8,9-dimethyl-2-(phenoxymethyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1n1c2ncn3c(c2c(c1C)C)nc(n3)COc1ccccc1

STK613360
Synonyms: 7-(2-bromoethoxy)-3-(4-chlorophenyl)-2-methyl-4H-chromen-4-one
Smiles: BrCCOc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)C

STK613364
Synonyms: N~2~-[(4-chlorophenyl)acetyl]-N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]glycinamide
Smiles: O=C(NCc1cc(=O)n(c(=O)n1C)C)CNC(=O)Cc1ccc(cc1)Cl

STK855333
Synonyms: 2-(2-chlorophenyl)-5-{4-[(4-methoxyphenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: COc1ccc(cc1)C(=O)N1CCN(CC1)c1oc(nc1C#N)c1ccccc1Cl

STK613366
Synonyms: 2-[(4-butyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-4-ylmethyl)propanamide
Smiles: CCCCc1cc(=O)oc2c1ccc(c2C)OC(C(=O)NCc1ccncc1)C

STK855334
Synonyms: 2-(6-chloro-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1,2,3,4-tetrahydroisoquinoline
Smiles: Cc1nc2ncnn2c(c1Cl)N1CCc2c(C1)cccc2

STK613369
Synonyms: 2-[4-(2-methoxyphenoxy)-3-methyl-1H-pyrazol-5-yl]-5-[(4-methylbenzyl)oxy]phenol
Smiles: COc1ccccc1Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1ccc(cc1)C

STK613370
Synonyms: 3-(4-methoxyphenyl)-N-phenyl[1,2,4]triazolo[4,3-b]pyridazin-6-amine
Smiles: COc1ccc(cc1)c1nnc2n1nc(cc2)Nc1ccccc1

STK613371
Synonyms: N-(4-acetylphenyl)-2-{[4-cyano-1-(pyrrolidin-1-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)C(=O)C)nc(c2c1CCCC2)N1CCCC1

STK855335
Synonyms: 7-(2-bromoethoxy)-3-phenyl-4H-chromen-4-one
Smiles: BrCCOc1ccc2c(c1)occ(c2=O)c1ccccc1

STK613372
Synonyms: N-butyl-4-methyl-2-(4-methylphenyl)-1,3-thiazole-5-carboxamide
Smiles: CCCCNC(=O)c1sc(nc1C)c1ccc(cc1)C

STK613377
Synonyms: N-[4-(2-chlorophenyl)-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)butyl]-1,3-thiazol-2-amine
Smiles: Clc1ccccc1CC(C1CCOC(C1)(C)C)CCNc1nccs1

STK613378
Synonyms: methyl2-{[(4-ethylpiperazin-1-yl)carbonyl]amino}-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: CCN1CCN(CC1)C(=O)Nc1sc2c(c1C(=O)OC)CC(OC2)(C)C

STK613385
Synonyms: 1-(2-{[3-(4-chlorophenyl)-4-oxo-4H-chromen-7-yl]oxy}ethyl)piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)CCOc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK613388
Synonyms: 3-{[2-(dimethylamino)ethyl]amino}-1-ethyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(NCCN(C)C)nc(c2c1CCCC2)CC

STK613391
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-{(5Z)-2,4-dioxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-1,3-thiazolidin-3-yl}-N-methylacetamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)C)CN1C(=O)S/C(=C\C=C\c2ccccc2)/C1=O

STK613392
Synonyms: 6-oxo-1-phenyl-N-(pyridin-3-yl)-1,4,5,6-tetrahydropyridazine-3-carboxamide
Smiles: O=C(C1=NN(C(=O)CC1)c1ccccc1)Nc1cccnc1

STK613393
Synonyms: 1-[(3R)-3-(4-chlorophenyl)-4-{[(4R)-1,3-thiazolidin-4-ylcarbonyl]amino}butanoyl]piperidine-4-carboxylicacid
Smiles: O=C([C@@H]1CSCN1)NCC(c1ccc(cc1)Cl)CC(=O)N1CCC(CC1)C(=O)O

STK613395
Synonyms: N-{2-[2-(4-methoxyphenyl)-1H-imidazol-5-yl]ethyl}-3,4-dimethylbenzamide
Smiles: COc1ccc(cc1)c1ncc([nH]1)CCNC(=O)c1ccc(c(c1)C)C

STK613398
Synonyms: [2,4-dioxo-1-(2-phenylethyl)-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl]aceticacid
Smiles: OC(=O)Cn1c(=O)n(CCc2ccccc2)c2c(c1=O)c1CCCCc1s2

STK613401
Synonyms: diethyl3-methyl-5-[(morpholin-4-ylcarbonyl)amino]thiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)N2CCOCC2)sc(c1C)C(=O)OCC

STK613403
Synonyms: N-(4-methoxyphenyl)-5-methyl-7-(2-methylpropyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1ccc(cc1)NC(=O)C1=C(C)Nc2n(C1CC(C)C)ncn2

STK613404
Synonyms: N-[3-(morpholin-4-yl)propyl]-4-(phenylsulfonyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]-1,3-oxazol-5-amine
Smiles: O=S(=O)(c1nc(oc1NCCCN1CCOCC1)/C=C/c1cccs1)c1ccccc1

STK613407
Synonyms: 2,4-dichloro-N-[3-(1H-tetrazol-1-yl)phenyl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)Nc1cccc(c1)n1cnnn1

STK613416
Synonyms: 5,6-dimethyl-N-[2-(morpholin-4-yl)ethyl]-7-(pyridin-3-ylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: Cc1c(C)n(c2c1c(NCCN1CCOCC1)ncn2)Cc1cccnc1

STK613417
Synonyms: 2-(3,4-dimethoxyphenyl)-N-{2-[2,2-dimethyl-4-(4-methylphenyl)tetrahydro-2H-pyran-4-yl]ethyl}ethanamine
Smiles: COc1ccc(cc1OC)CCNCCC1(CCOC(C1)(C)C)c1ccc(cc1)C

STK613421
Synonyms: 1-(4-methylbenzyl)-N-(pyridin-3-ylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Smiles: Cc1ccc(cc1)Cn1ncc2c1ncnc2NCc1cccnc1

STK613424
Synonyms: 2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(pyridin-2-yl)acetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)Nc1ccccn1

STK613427
Synonyms: 4-ethyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCN1C(=O)COc2c(C1=O)cccc2

STK613435
Synonyms: 2-{4-[4-cyano-1-(furan-2-yl)-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl]piperazin-1-yl}-N-(3-methoxyphenyl)acetamide
Smiles: N#Cc1c(nc(c2c1CCC2)c1ccco1)N1CCN(CC1)CC(=O)Nc1cccc(c1)OC

STK613437
Synonyms: methylN-{[3-hydroxy-2-(propan-2-yl)quinoxalin-1(2H)-yl]carbonyl}leucinate
Smiles: COC(=O)C(NC(=O)N1C(C(C)C)C(=Nc2c1cccc2)O)CC(C)C

STK855340
Synonyms: 2-{4-[2-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-d]pyrimidin-4-yl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1nc(SC)nc2c1sc1c2CCCC1

STK613441
Synonyms: 4-tert-butyl-N-[1-oxo-1-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)propan-2-yl]benzamide
Smiles: O=C(C(NC(=O)c1ccc(cc1)C(C)(C)C)C)N1CCC2(CC1)NCCc1c2[nH]cn1

STK613442
Synonyms: 4-({4-[(E)-(4-hydroxy-2,6-dioxo-1-phenyl-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]-2-methoxyphenoxy}methyl)benzoicacid
Smiles: COc1cc(ccc1OCc1ccc(cc1)C(=O)O)/C=C/1\C(=NC(=O)N(C1=O)c1ccccc1)O

STK613445
Synonyms: N-(2-{[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]amino}-2-oxoethyl)-3,4-dimethylbenzamide
Smiles: O=C(NCc1cc(=O)n(c(=O)n1C)C)CNC(=O)c1ccc(c(c1)C)C

STK855342
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[(2Z)-2-(2,3-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetamide
Smiles: COc1c(cccc1OC)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)Nc1ccc2c(c1)OCCO2

STK613446
Synonyms: 3-(4-chlorophenyl)-7-[2-(piperidin-1-yl)ethoxy]-4H-chromen-4-one
Smiles: Clc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCCN1CCCCC1

STK613447
Synonyms: 6-butyl-2-cyclohexyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: CCCCc1c(C)nc2n(c1O)nc(n2)C1CCCCC1

STK613449
Synonyms: 6-methoxy-2-[3-(morpholin-4-yl)propyl]-1-[4-(propan-2-yl)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)CCCN1CCOCC1)c1ccc(cc1)C(C)C

STK613450
Synonyms: 4-fluoro-N-[2-(2-phenyl-1H-imidazol-5-yl)ethyl]benzamide
Smiles: Fc1ccc(cc1)C(=O)NCCc1cnc([nH]1)c1ccccc1

STK855345
Synonyms: propyl{[4-(2-chlorophenyl)-3-cyano-6-methyl-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetate
Smiles: CCCOC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1)c1ccccc1Cl

STK613455
Synonyms: 8,9-dimethyl-7-(2-methylpropyl)-2-(thiophen-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC(Cn1c(C)c(c2c1ncn1c2nc(n1)c1cccs1)C)C

STK613456
Synonyms: 2-hydroxy-1-phenyl-6-(pyridin-3-ylmethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Oc1nc(=O)c2c(n1c1ccccc1)NCN(C2)Cc1cccnc1

STK613457
Synonyms: N-(1-benzylpiperidin-4-yl)-2-[(4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]propanamide
Smiles: Cc1cc(OC(C(=O)NC2CCN(CC2)Cc2ccccc2)C)c2c(c1)oc(=O)cc2C

STK613458
Synonyms: 2-({[(3-hydroxypropyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylicacid
Smiles: OCCCNC(=O)C(=O)Nc1sc2c(c1C(=O)O)CC(OC2)(C)C

STK613459
Synonyms: 8,9-dimethyl-7-(6-methylpyridin-2-yl)-2-(pyridin-3-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1cccc(n1)n1c(C)c(c2c1ncn1c2nc(n1)c1cccnc1)C

STK613460
Synonyms: 2-(3,4-dimethoxyphenyl)-7-(furan-2-ylmethyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2)n(c(c1C)C)Cc1ccco1

STK855346
Synonyms: 2-[(4-fluorophenyl)amino]-8-methyl-4-(thiophen-2-yl)-4,9-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Smiles: Fc1ccc(cc1)NC1=NC(c2cccs2)n2c(=N1)[nH]c(cc2=O)C

STK613463
Synonyms: 2-[4-(4-chlorophenyl)-1H-pyrazol-5-yl]-5-[2-(4-phenylpiperazin-1-yl)ethoxy]phenol
Smiles: Clc1ccc(cc1)c1cn[nH]c1c1ccc(cc1O)OCCN1CCN(CC1)c1ccccc1

STK613468
Synonyms: N-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)Nc1ccc2c(c1)nc(n2C)CCn1nc(cc1C)C

STK613473
Synonyms: N-{2-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]ethyl}benzenesulfonamide
Smiles: O=S(=O)(c1ccccc1)NCCc1csc(n1)c1cccs1

STK613476
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-[(5Z)-5-(2-fluorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: O=C(CN1C(=O)S/C(=C\c2ccccc2F)/C1=O)NC1CCS(=O)(=O)C1

STK613477
Synonyms: 2-[4-imino-5,6-dimethyl-7-(pyridin-3-ylmethyl)-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N,N-dimethylethanamine
Smiles: CN(CCn1cnc2c(c1=N)c(C)c(n2Cc1cccnc1)C)C

STK613479
Synonyms: 2-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]-2-ethoxyphenoxy}-N-(3-methylphenyl)acetamide
Smiles: CCOc1cc(ccc1OCC(=O)Nc1cccc(c1)C)/C=C/c1nc(O)nc(c1[N+](=O)[O-])O

STK613481
Synonyms: 5-{4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}-4-hydroxy-2-methyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: COc1cc(ccc1OCc1ccccc1Cl)C1CC(=O)Nc2c1c(O)nc(n2)C

STK613482
Synonyms: N-benzyl-7-(4-chlorophenyl)-5-methyl-3,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: Clc1ccc(cc1)C1C(=C(C)N=c2n1nn[nH]2)C(=O)NCc1ccccc1

STK613483
Synonyms: 3-(2-chlorobenzyl)-2-methylpyrimido[1,2-a]benzimidazol-4-ol
Smiles: Cc1nc2nc3c(n2c(c1Cc1ccccc1Cl)O)cccc3

STK855350
Synonyms: N-(4-chlorophenyl)-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)N1CC(=Nc2c1cccc2)O

STK855351
Synonyms: (2Z)-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl3-methoxybenzoate
Smiles: COc1cccc(c1)C(=O)Oc1cc2O/C(=C\c3cccnc3)/C(=O)c2c(c1)C

STK613487
Synonyms: (1Z)-1-(4-bromophenyl)-N-{[8,9-dimethyl-7-(pyridin-3-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}ethanimine
Smiles: Brc1ccc(cc1)/C(=N\OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1cccnc1)/C

STK613488
Synonyms: 2-{[4-cyano-1-(morpholin-4-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}-N-(tetrahydrofuran-2-ylmethyl)acetamide
Smiles: N#Cc1c(SCC(=O)NCC2CCCO2)nc(c2c1CCCC2)N1CCOCC1

STK613489
Synonyms: 3-{7-[3-(dimethylamino)propyl]-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl}naphthalen-2-ol
Smiles: CN(CCCn1c(C)c(c2c1ncn1c2nc(n1)c1cc2ccccc2cc1O)C)C

STK613490
Synonyms: 5-oxo-6-(propan-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl2-chlorobenzoate
Smiles: CC(c1c(OC(=O)c2ccccc2Cl)nc2n(c1=O)CCS2)C

STK613495
Synonyms: 4-(3,5-dimethyl-1H-pyrazol-1-yl)-1-(4-methylbenzyl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1ccc(cc1)Cn1ncc2c1ncnc2n1nc(cc1C)C

STK613499
Synonyms: 2-[4-(2-methoxyphenyl)-3-methyl-1H-pyrazol-5-yl]-5-[(2-methylbenzyl)oxy]phenol
Smiles: COc1ccccc1c1c(C)n[nH]c1c1ccc(cc1O)OCc1ccccc1C

STK613500
Synonyms: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide
Smiles: N#Cc1c(NC(=O)Cc2nn3c(n2)nc(cc3C)C)sc2c1CCCCC2

STK855354
Synonyms: 1-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl}-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK613505
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanamide
Smiles: O=C(NC1CCS(=O)(=O)C1)CCc1c(=O)oc2c(c1C)ccc(c2)O

STK613507
Synonyms: 2-(4-bromophenyl)-5-(2,3-dichlorophenyl)-4-phenyl-1H-imidazole
Smiles: Brc1ccc(cc1)c1[nH]c(c(n1)c1ccccc1)c1cccc(c1Cl)Cl

STK613508
Synonyms: 3-(1H-benzimidazol-2-yl)-N-[4-(dimethylamino)phenyl]propanamide
Smiles: O=C(Nc1ccc(cc1)N(C)C)CCc1nc2c([nH]1)cccc2

STK613511
Synonyms: phenyl(3-phenyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)methanone
Smiles: O=C(N1CCc2c(C1)c(n[nH]2)c1ccccc1)c1ccccc1

STK613521
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1)C

STK613522
Synonyms: N-(4-fluorophenyl)-5-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-7-(4-hydroxyphenyl)-6,7-dihydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: Oc1ccc(cc1)C1CC(=Nc2n1ncc2C(=O)Nc1ccc(cc1)F)c1c(O)cc(oc1=O)C

STK855357
Synonyms: 3-(3,4-dimethoxyphenyl)-6-ethyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)c(c2O)CC

STK613526
Synonyms: 2-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[4-(propan-2-yl)phenyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)Nc1ccc(cc1)C(C)C

STK613530
Synonyms: 1-(2-chlorobenzyl)-4-(4-phenylpiperazin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Clc1ccccc1Cn1ncc2c1ncnc2N1CCN(CC1)c1ccccc1

STK613531
Synonyms: 1-(propan-2-yl)-3-[4-(pyrrolidin-1-ylacetyl)piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
Smiles: N#Cc1c(nc(c2c1CCC2)C(C)C)N1CCN(CC1)C(=O)CN1CCCC1

STK613532
Synonyms: 2-[2-(4-methoxybenzyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl]-N,N-dimethylethanamine
Smiles: COc1ccc(cc1)Cc1nn2c(n1)c1c(nc2)n(c(c1C)C)CCN(C)C

STK613534
Synonyms: 1-{4-[(5Z)-5-(2-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}piperidine-2-carboxylicacid
Smiles: COc1ccccc1/C=C/1\SC(=S)N(C1=O)CCCC(=O)N1CCCCC1C(=O)O

STK613539
Synonyms: N-[(2E)-5,5-dioxido-3-(2-phenylethyl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-phenylpropanamide
Smiles: O=C(/N=C\1/SC2C(N1CCc1ccccc1)CS(=O)(=O)C2)CCc1ccccc1

STK613543
Synonyms: (3S)-3-(4-chlorophenyl)-4-{[3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoyl]amino}butanoicacid
Smiles: O=C(CCc1c(=O)oc2c(c1C)ccc(c2)O)NCC(c1ccc(cc1)Cl)CC(=O)O

STK613544
Synonyms: 2-[5-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-[(4-methylbenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1c(ncnc1C(F)(F)F)c1ccc(cc1O)OCc1ccc(cc1)C

STK613545
Synonyms: 2-({[3-(dimethylamino)propyl]carbamoyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxamide
Smiles: CN(CCCNC(=O)Nc1sc2c(c1C(=O)N)CC(OC2)(C)C)C

STK613547
Synonyms: 2-(2-{[7,7-dimethyl-2-(propan-2-ylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]amino}ethoxy)ethanol
Smiles: OCCOCCNc1nc(SC(C)C)nc2c1sc1c2COC(C1)(C)C

STK613549
Synonyms: 5-[(2-chloro-6-fluorobenzyl)oxy]-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol
Smiles: Oc1cc(ccc1c1onc(c1c1ccccc1)C)OCc1c(F)cccc1Cl

STK613552
Synonyms: (1Z)-N-{[8,9-dimethyl-7-(pyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}-1-phenylethanimine
Smiles: C/C(=N/OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1ccccn1)/c1ccccc1

STK613558
Synonyms: 1-(2-chlorobenzyl)-N-(pyridin-2-ylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Smiles: Clc1ccccc1Cn1ncc2c1ncnc2NCc1ccccn1

STK613559
Synonyms: 7-benzyl-5,6-dimethyl-3-(pyridin-3-ylmethyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1c(C)c2c(n1Cc1ccccc1)ncn(c2=N)Cc1cccnc1

STK613560
Synonyms: 1-(2-chlorobenzyl)-2-hydroxy-6-(1-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Clc1ccccc1Cn1c(O)nc(=O)c2c1NCN(C2)C(c1ccccc1)C

STK855359
Synonyms: (2Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(4-bromo-2-fluorophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1F)Br)/c1scc(n1)c1ccc2c(c1)OCO2

STK613565
Synonyms: N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-2-sulfonamide
Smiles: Cc1ccn2c(c1)nc(c2)c1ccc(cc1)NS(=O)(=O)c1ccc2c(c1)cccc2

STK613566
Synonyms: (2,3-dimethyl-1H-indol-5-yl)[4-(naphthalen-2-ylsulfonyl)piperazin-1-yl]methanone
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cccc2

STK613568
Synonyms: 4-hydroxy-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2-carboxylicacid
Smiles: OC(=O)c1nc(O)c2c(n1)sc1c2CC(OC1)(C)C

STK855360
Synonyms: (5E)-1-(3,5-dimethylphenyl)-2-hydroxy-5-[(5-iodofuran-2-yl)methylidene]pyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cc(C)cc(c1)N1C(=NC(=O)/C(=C\c2ccc(o2)I)/C1=O)O

STK613572
Synonyms: 3-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)propanamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK613575
Synonyms: (3S)-N-[(2S)-1-[(3,5-dimethylphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1cc(C)cc(c1)C)NC(=O)[C@H]1NCc2c(C1)cccc2

STK613579
Synonyms: 5-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethoxy}-2-(4-phenyl-1H-pyrazol-5-yl)phenol
Smiles: Fc1ccccc1N1CCN(CC1)CCOc1ccc(c(c1)O)c1[nH]ncc1c1ccccc1

STK613580
Synonyms: 6-methyl-3-{[2-(phenylsulfanyl)phenyl]amino}-1,2,4-triazin-5-ol
Smiles: Cc1nnc(nc1O)Nc1ccccc1Sc1ccccc1

STK613584
Synonyms: N'-[3-(4-chlorophenyl)-3-(4-fluorophenyl)propyl]-N,N-dimethylpropane-1,3-diamine
Smiles: CN(CCCNCCC(c1ccc(cc1)Cl)c1ccc(cc1)F)C

STK613585
Synonyms: 3-(4-bromophenyl)-7-[2-(4-methylpiperazin-1-yl)ethoxy]-4H-chromen-4-one
Smiles: CN1CCN(CC1)CCOc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Br

STK613586
Synonyms: 1-[2-(5-amino-1-methyl-1H-benzimidazol-2-yl)ethyl]pyridin-2(1H)-one
Smiles: Nc1ccc2c(c1)nc(n2C)CCn1ccccc1=O

STK613592
Synonyms: 3-[2-(furan-2-yl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl]propan-1-ol
Smiles: OCCCn1c(C)c(c2c1ncn1c2nc(n1)c1ccco1)C

STK613594
Synonyms: 2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]-N-(pyridin-3-ylmethyl)propanamide
Smiles: CCCc1cc(=O)oc2c1c(cc(c2)C)OC(C(=O)NCc1cccnc1)C

STK613598
Synonyms: N-butyl-7-(furan-2-ylmethyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: CCCCNc1ncnc2c1c(C)c(n2Cc1ccco1)C

STK613599
Synonyms: 5-[(2,6-dichlorobenzyl)oxy]-2-[5-(2-methoxyphenyl)pyrimidin-4-yl]phenol
Smiles: COc1ccccc1c1cncnc1c1ccc(cc1O)OCc1c(Cl)cccc1Cl

STK855364
Synonyms: 4-phenyl-5-(thiophen-2-yl)-2-(2,4,5-trimethoxyphenyl)-1H-imidazole
Smiles: COc1cc(OC)c(cc1c1[nH]c(c(n1)c1ccccc1)c1cccs1)OC

STK613609
Synonyms: 2-{[{[3-(dimethylamino)propyl]amino}(oxo)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylicacid
Smiles: CN(CCCNC(=O)C(=O)Nc1sc2c(c1C(=O)O)CCC2)C

STK613611
Synonyms: 2-[(8-methyl-2-oxo-4-propyl-2H-chromen-7-yl)oxy]-N-(pyridin-2-ylmethyl)propanamide
Smiles: CCCc1cc(=O)oc2c1ccc(c2C)OC(C(=O)NCc1ccccn1)C

STK855365
Synonyms: 2-[2-amino-5-(3-methoxyphenoxy)pyrimidin-4-yl]-5-[(4-chlorobenzyl)oxy]phenol
Smiles: COc1cccc(c1)Oc1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1)Cl)N

STK613613
Synonyms: 2-[4-(3,4-dimethoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-5-[(4-ethenylbenzyl)oxy]phenol
Smiles: C=Cc1ccc(cc1)COc1ccc(c(c1)O)c1onc(c1c1ccc(c(c1)OC)OC)C

STK613618
Synonyms: N-[(2S)-1-hydroxy-3-methylpentan-2-yl]-2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]acetamide
Smiles: CCCc1cc(=O)oc2c1c(OCC(=O)N[C@@H]([C@@H](CC)C)CO)cc(c2)C

STK613619
Synonyms: 5-[(2-chloro-4-fluorobenzyl)oxy]-2-[4-(4-methoxyphenoxy)-1H-pyrazol-5-yl]phenol
Smiles: COc1ccc(cc1)Oc1cn[nH]c1c1ccc(cc1O)OCc1ccc(cc1Cl)F

STK613622
Synonyms: N-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]pentanamide
Smiles: CCCCC(=O)Nc1nnc(s1)S(=O)(=O)CC

STK613623
Synonyms: N-(2-benzyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-beta-alanine
Smiles: OC(=O)CCNc1nc(Cc2ccccc2)nc2c1c1CCCCc1s2

STK613628
Synonyms: (5Z)-6-hydroxy-5-[5-(1H-indol-3-yl)pyrazolidin-3-ylidene]-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C\2/NNC(C2)c2c[nH]c3c2cccc3)/C1=O)O

STK855368
Synonyms: methyl4-[2-(pyridin-2-yl)-1H-indol-3-yl]butanoate
Smiles: COC(=O)CCCc1c([nH]c2c1cccc2)c1ccccn1

STK613629
Synonyms: 9-(2,4-dimethoxyphenyl)-6-[(E)-2-phenylethenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(c(c1)OC)C1C2=C(O)CC(CC2=Nc2n1ncn2)/C=C/c1ccccc1

STK613630
Synonyms: 2-{[5,6-dimethyl-7-(pyridin-3-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}ethanol
Smiles: OCCNc1ncnc2c1c(C)c(n2c1cccnc1)C

STK613632
Synonyms: 2-(2-methoxyphenyl)-12-(4-methoxyphenyl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: COc1ccc(cc1)C1C2=C(CCCC2=O)Oc2c1c1nc(nn1cn2)c1ccccc1OC

STK613635
Synonyms: 2-[(6-methoxy-4-methylquinazolin-2-yl)amino]-6-methyl-5-propylpyrimidin-4-ol
Smiles: CCCc1c(C)nc(nc1O)Nc1nc(C)c2c(n1)ccc(c2)OC

STK613637
Synonyms: 6-[(E)-2-{2-[(2-fluorobenzyl)oxy]phenyl}ethenyl]-5-nitropyrimidine-2,4-diol
Smiles: Oc1nc(/C=C/c2ccccc2OCc2ccccc2F)c(c(n1)O)[N+](=O)[O-]

STK613639
Synonyms: 4-hydroxy-2-methyl-5-(naphthalen-1-yl)-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C1Nc2nc(C)nc(c2C(C1)c1cccc2c1cccc2)O

STK613640
Synonyms: [(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-nitrophenyl)-4,5-dihydro-1,2-oxazol-5-yl]aceticacid
Smiles: OC(=O)C[C@]1(ON=C(C1)c1ccc(cc1)[N+](=O)[O-])C(=O)Nc1ccc(cc1C)C

STK613642
Synonyms: N-{[1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]carbonyl}-L-valyl-L-valine
Smiles: CC([C@@H](C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)C1CC(=O)N(C1)c1ccc(cc1)F)C

STK613643
Synonyms: ethyl3-[3-(4-fluorophenyl)-7-hydroxy-2,5-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanoate
Smiles: CCOC(=O)CCc1c(C)nc2n(c1O)nc(c2c1ccc(cc1)F)C

STK613646
Synonyms: (2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(3-methoxyphenyl)propanamide
Smiles: COc1cccc(c1)NC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)C

STK613648
Synonyms: 7-ethyl-4-(furan-2-yl)-2-[(4-methoxyphenyl)amino]-8-methyl-4,9-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Smiles: CCc1c(C)[nH]c2=NC(=NC(n2c1=O)c1ccco1)Nc1ccc(cc1)OC

STK613652
Synonyms: methylN-(2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-1-ylcarbonyl)-L-alaninate
Smiles: COC(=O)[C@@H](NC(=O)N1CCn2c1nc1c2cccc1)C

STK855374
Synonyms: (2Z)-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-ylmorpholine-4-carboxylate
Smiles: O=C(N1CCOCC1)Oc1cc2O/C(=C\c3cccnc3)/C(=O)c2c(c1)C

STK613653
Synonyms: 2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-chromen-7-yl)oxy]-N-[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Cn1ncnc1)COc1cc(O)c2c(c1)OC(CC2=O)(C)C

STK855375
Synonyms: 2-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone
Smiles: O=C(N1CCc2c(C1)cccc2)Cc1nn2c(n1)nc(c(c2C)Cl)C

STK613657
Synonyms: [(5S)-5-[(5-chloro-2-methoxyphenyl)carbamoyl]-3-(2,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]aceticacid
Smiles: COc1ccc(cc1NC(=O)[C@@]1(ON=C(C1)c1ccc(cc1Cl)Cl)CC(=O)O)Cl

STK855376
Synonyms: N-[(2Z)-5-(ethylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-5,7-dimethyl-4-oxo-4H-chromene-2-carboxamide
Smiles: CCSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)cc(cc3C)C)/s1

STK613658
Synonyms: 1,3-dimethyl-5-({[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CN1C(=O)N(C)C(=O)C(=CNc2ccc(cc2)Cn2ncnc2)C1=O

STK613660
Synonyms: 2-[4-(6-hydroxy-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)phenoxy]acetamide
Smiles: NC(=O)COc1ccc(cc1)C1CC(=Nc2c1c(C)nn2c1ccccc1)O

STK855377
Synonyms: 2-(2-fluorophenyl)-5-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1cccs1)c1ccccc1F

STK613663
Synonyms: 2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[3-(dimethylamino)propyl]acetamide
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)NCCCN(C)C

STK613664
Synonyms: [1-(2-amino-2-oxoethyl)-2,4-dioxo-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl]aceticacid
Smiles: NC(=O)Cn1c2sc3c(c2c(=O)n(c1=O)CC(=O)O)CCC3

STK613667
Synonyms: 7-(azepan-1-yl)-3-(3,4-dimethoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidine
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)cc2N1CCCCCC1

STK613669
Synonyms: (5E)-1-(3-chlorophenyl)-2-hydroxy-5-{[(5-methyl-1,2-oxazol-3-yl)amino]methylidene}pyrimidine-4,6(1H,5H)-dione
Smiles: Clc1cccc(c1)N1C(=NC(=O)/C(=C\Nc2noc(c2)C)/C1=O)O

STK613674
Synonyms: 2-{4-[4-cyano-1-(furan-2-yl)-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl]piperazin-1-yl}acetamide
Smiles: N#Cc1c(nc(c2c1CCC2)c1ccco1)N1CCN(CC1)CC(=O)N

STK613682
Synonyms: N-[(2E)-5-(butylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-methylbutanamide
Smiles: CCCCS(=O)(=O)c1n[nH]/c(=N\C(=O)CC(C)C)/s1

STK855380
Synonyms: 2-(2-chlorophenyl)-5-{4-[(2-methoxyphenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccccc1OC)c1ccccc1Cl

STK613686
Synonyms: 2-(2-chlorophenyl)-8,9-dimethyl-7-(pyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccccc1c1nn2c(n1)c1c(nc2)n(c(c1C)C)c1ccccn1

STK613690
Synonyms: 2-[(1-ethylpiperidin-4-yl)amino]-7H-naphtho[1,2,3-de]quinolin-7-one
Smiles: CCN1CCC(CC1)Nc1nc2cccc3c2c(c1)c1ccccc1C3=O

STK613691
Synonyms: 3-methyl-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]thiophene-2-carboxamide
Smiles: C[C@@H](c1nnc2n1cccc2)NC(=O)c1sccc1C

STK613692
Synonyms: 7,9-dimethyl-N-phenylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-amine
Smiles: Cc1cc(C)c2c(n1)sc1c2ncnc1Nc1ccccc1

STK855382
Synonyms: (2Z)-2-(3-methoxybenzylidene)-6-[2-(morpholin-4-yl)-2-oxoethoxy]-1-benzofuran-3(2H)-one
Smiles: COc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)N1CCOCC1

STK613698
Synonyms: 3-[(4-fluorobenzyl)amino]-6-methyl-1,2,4-triazin-5-ol
Smiles: Fc1ccc(cc1)CNc1nnc(c(n1)O)C

STK613700
Synonyms: 2-{[(pyridin-4-ylmethyl)carbamoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(Nc1sc2c(c1C(=O)N)CCCC2)NCc1ccncc1

STK613701
Synonyms: N-(4-methoxybenzyl)-4-methyl-2-(4-methylphenyl)-1,3-thiazole-5-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1sc(nc1C)c1ccc(cc1)C

STK613705
Synonyms: N-(1H-benzimidazol-2-yl)-4-[(2-hydroxy-4-oxoquinazolin-3(4H)-yl)methyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1c(O)nc2c(c1=O)cccc2)Nc1nc2c([nH]1)cccc2

STK613706
Synonyms: 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-8,10-dimethyl-2-propylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine
Smiles: CCCc1cc(N2CCN(CC2)c2nc(C)cc(n2)C)n2c(n1)c1c(C)cc(nc1n2)C

STK613707
Synonyms: 2-[(2-hydroxyphenyl)carbonyl]hydrazinecarboxamide
Smiles: NC(=O)NNC(=O)c1ccccc1O

STK613708
Synonyms: N-(2-chlorobenzyl)-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Smiles: O=C(c1ccc2c(c1)[nH]c(=O)c(=O)[nH]2)NCc1ccccc1Cl

STK613710
Synonyms: 2-(6-methyl-1-benzofuran-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Smiles: O=C(Cc1coc2c1ccc(c2)C)Nc1noc(c1)C

STK613715
Synonyms: 3-(4-methoxyphenyl)-6-methyl-2-(phenylamino)-4H-furo[3,2-c]pyran-4-one
Smiles: COc1ccc(cc1)c1c(Nc2ccccc2)oc2c1c(=O)oc(c2)C

STK613716
Synonyms: 2-(4-methoxyphenyl)-N-[2-oxo-2-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)ethyl]acetamide
Smiles: COc1ccc(cc1)CC(=O)NCC(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK613717
Synonyms: [2,4-dioxo-1-(propan-2-yl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl]aceticacid
Smiles: OC(=O)Cn1c(=O)c2c3CCCc3sc2n(c1=O)C(C)C

STK613718
Synonyms: 8,9-dimethyl-7-(2-methylpropyl)-2-phenyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC(Cn1c(C)c(c2c1ncn1c2nc(n1)c1ccccc1)C)C

STK855385
Synonyms: 6-benzyl-5-methyl-N-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Smiles: CCCNc1c(Cc2ccccc2)c(C)nc2n1ncn2

STK613720
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]thiophene-2-carboxamide
Smiles: O=C(c1cccs1)NCc1cc(=O)n(c(=O)n1C)C

STK613721
Synonyms: 4-{(2E)-2-[1-(pyridin-4-yl)ethylidene]hydrazinyl}pyrimidin-2(1H)-one
Smiles: O=c1[nH]ccc(n1)N/N=C(/c1ccncc1)\C

STK855386
Synonyms: 1,7-dimethyl-3-(2-oxopropyl)-8-propyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)C

STK613724
Synonyms: N-(2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-1-ylcarbonyl)-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)N1CCn2c1nc1c2cccc1

STK613727
Synonyms: 3-(4-chlorophenyl)-7-[2-(4-ethylpiperazin-1-yl)ethoxy]-4-methyl-2H-chromen-2-one
Smiles: CCN1CCN(CC1)CCOc1ccc2c(c1)oc(=O)c(c2C)c1ccc(cc1)Cl

STK855387
Synonyms: 2-methoxyethyl4-(2-chlorophenyl)-5-cyano-2-methyl-6-(methylsulfanyl)-1,4-dihydropyridine-3-carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SC

STK613731
Synonyms: 6,6,9-trimethyl-2-phenyl-4,6,6a,7,8,9,10,10a-octahydro-1H-isochromeno[3,4-d]pyrimidine-1,3(2H)-dione
Smiles: CC1CCC2C(C1)c1c(OC2(C)C)[nH]c(=O)n(c1=O)c1ccccc1

STK613733
Synonyms: N-{1-[(3,5-dimethoxyphenyl)amino]-3-methyl-1-oxobutan-2-yl}-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: COc1cc(NC(=O)C(C(C)C)NC(=O)N2CC(=Nc3c2cccc3)O)cc(c1)OC

STK613734
Synonyms: 3-(3,4-dimethoxyphenyl)-7-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2,5-dimethylpyrazolo[1,5-a]pyrimidine
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)cc2N1CCN(CC1)c1nc(C)cc(n1)C

STK613735
Synonyms: 5-bromo-N-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)ethyl]furan-2-carboxamide
Smiles: Brc1ccc(o1)C(=O)NCCc1csc2=NCCn12

STK613736
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-Nalpha-(thiophen-2-ylcarbonyl)phenylalaninamide
Smiles: O=C(C(NC(=O)c1cccs1)Cc1ccccc1)NCc1cc(=O)n(c(=O)n1C)C

STK613737
Synonyms: (2E)-3-[(3-fluorophenyl)amino]-2-[(4-methoxyphenyl)sulfonyl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)F)/S(=O)(=O)c1ccc(cc1)OC

STK613738
Synonyms: 7-(4-acetylpiperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-N-(pyridin-4-ylmethyl)-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)NCc2ccncc2)c(=O)c2c1cc(N1CCN(CC1)C(=O)C)c(c2)F

STK855389
Synonyms: 2-(4-fluorophenyl)-5-{4-[(2-methoxyphenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccccc1OC)c1ccc(cc1)F

STK613739
Synonyms: 3-({2-[(2,3-dimethyl-1H-indol-5-yl)carbonyl]hydrazinyl}carbonyl)-N,N-diethylbenzenesulfonamide
Smiles: CCN(S(=O)(=O)c1cccc(c1)C(=O)NNC(=O)c1ccc2c(c1)c(C)c([nH]2)C)CC

STK613740
Synonyms: {4-[3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl}acetonitrile
Smiles: CC(c1cc(N2CCN(CC2)CC#N)n2c(n1)c(cn2)c1ccccc1)C

STK613742
Synonyms: 3-cycloheptyl-5,6-dimethyl-7-(pyridin-2-yl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1c(C)n(c2c1c(=N)n(cn2)C1CCCCCC1)c1ccccn1

STK613743
Synonyms: 2-({[4-(ethoxycarbonyl)piperazin-1-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylicacid
Smiles: CCOC(=O)N1CCN(CC1)C(=O)Nc1sc2c(c1C(=O)O)CCCC2

STK613747
Synonyms: 4-{[3-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]oxy}benzonitrile
Smiles: N#Cc1ccc(cc1)Oc1ccc2n(n1)c(nn2)c1ccc(cc1)C

STK613750
Synonyms: {1-[({(Z)-[4-hydroxy-1-(3-methoxypropyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}amino)methyl]cyclohexyl}aceticacid
Smiles: COCCCN1C(=O)N=C(/C(=C/NCC2(CCCCC2)CC(=O)O)/C1=O)O

STK613751
Synonyms: 2-[(5Z)-5-(3-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]acetamide
Smiles: OCC(Cc1ccccc1)NC(=O)CN1C(=S)S/C(=C\c2cccc(c2)Cl)/C1=O

STK855391
Synonyms: 3-[(3-chloro-4-methoxyphenyl)amino]-1,2,4-triazin-5-ol
Smiles: COc1ccc(cc1Cl)Nc1nncc(n1)O

STK855392
Synonyms: methyl4-[({5-chloro-2-[(4-methylbenzyl)sulfanyl]pyrimidin-4-yl}carbonyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)c1nc(ncc1Cl)SCc1ccc(cc1)C

STK613753
Synonyms: 3-(5-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)-N-[(2Z)-6-methyl-1,3-benzothiazol-2(3H)-ylidene]propanamide
Smiles: O=C(/N=c\1/[nH]c2c(s1)cc(cc2)C)CCn1c(=O)oc2c1cc(Cl)cc2

STK613758
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-[(5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccco2)/C1=O)NC1CCS(=O)(=O)C1

STK613760
Synonyms: 3,4,6-trimethyl-N-[4-(thiophen-2-yl)-1,2,5-oxadiazol-3-yl]-1-benzofuran-2-carboxamide
Smiles: Cc1cc(C)c2c(c1)oc(c2C)C(=O)Nc1nonc1c1cccs1

STK613764
Synonyms: 2-[(3-hydroxypropyl)amino]-6-methylpyrimidin-4-ol
Smiles: OCCCNc1nc(C)cc(n1)O

STK855397
Synonyms: 5,5-dimethyl-2-{[(3-methylbutyl)carbamoyl]amino}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxamide
Smiles: CC(CCNC(=O)Nc1sc2c(c1C(=O)N)CC(OC2)(C)C)C

STK613767
Synonyms: 2-(2,5-dichlorophenyl)-5-[(2Z)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)acetyl]-1H-isoindole-1,3(2H)-dione
Smiles: Clc1ccc(c(c1)N1C(=O)c2c(C1=O)ccc(c2)C(=O)/C=C/1\NCCc2c1cc1OCOc1c2)Cl

STK855398
Synonyms: N-(3-{5-[4-(dimethylamino)phenyl]-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazol-3-yl}phenyl)methanesulfonamide
Smiles: CN(c1ccc(cc1)C1CC(=NN1S(=O)(=O)C)c1cccc(c1)NS(=O)(=O)C)C

STK613773
Synonyms: 3-methylbutyl(2Z)-3-(4-methoxyphenyl)-2-{[(2-methoxyphenyl)carbonyl]amino}prop-2-enoate
Smiles: COc1ccc(cc1)/C=C(/C(=O)OCCC(C)C)\NC(=O)c1ccccc1OC

STK613775
Synonyms: 1-(4-chlorobenzyl)-4-[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Smiles: CC(=C)CN1CCN(CC1)c1ncnc2c1cnn2Cc1ccc(cc1)Cl

STK613778
Synonyms: 7-[2-(3,4-dimethoxyphenyl)ethyl]-2-(furan-2-yl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1cc(ccc1OC)CCn1c(C)c(c2c1ncn1c2nc(n1)c1ccco1)C

STK613779
Synonyms: 2-[(4-butyl-6-chloro-2-oxo-2H-chromen-7-yl)oxy]-N-(3-hydroxypropyl)propanamide
Smiles: CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(C(=O)NCCCO)C

STK613781
Synonyms: 3-methyl-4-(naphthalen-2-yl)-1-phenyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: OC1=Nc2c(C(C1)c1ccc3c(c1)cccc3)c(nn2c1ccccc1)C

STK613782
Synonyms: 2-(4-methoxyphenyl)-N-(9-oxo-9H-xanthen-3-yl)acetamide
Smiles: COc1ccc(cc1)CC(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1

STK855401
Synonyms: 4-(morpholin-4-ylmethyl)-6-(propan-2-yl)-2H-chromen-2-one
Smiles: O=c1cc(CN2CCOCC2)c2c(o1)ccc(c2)C(C)C

STK613785
Synonyms: ethyl4-amino-2-{[2-(dimethylamino)ethyl]sulfanyl}-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
Smiles: CCOC(=O)c1sc2c(c1C)c(N)nc(n2)SCCN(C)C

STK613791
Synonyms: 5-(2,4-dimethylphenyl)-4-hydroxy-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C1Nc2nc(nc(c2C(C1)c1ccc(cc1C)C)O)c1ccccc1

STK855403
Synonyms: ethyl4-(3,4-dimethoxyphenyl)-2-(formylamino)thiophene-3-carboxylate
Smiles: O=CNc1scc(c1C(=O)OCC)c1ccc(c(c1)OC)OC

STK613794
Synonyms: 2-(4-fluorophenyl)-8,9-dimethyl-7-[3-(morpholin-4-yl)propyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Fc1ccc(cc1)c1nn2c(n1)c1c(nc2)n(c(c1C)C)CCCN1CCOCC1

STK613795
Synonyms: N-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-methylbutanamide
Smiles: CC(CC(=O)Nc1ccc2c(c1)nc(n2C)CCn1nc(cc1C)C)C

STK613799
Synonyms: 1-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione
Smiles: COc1ccc(cc1)C1C=C(Nc2n1nc(n2)N1C(=O)CCC1=O)c1ccccc1

STK613800
Synonyms: [3-(4-methoxyphenyl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl](phenyl)methanone
Smiles: COc1ccc(cc1)c1n[nH]c2c1CN(CC2)C(=O)c1ccccc1

STK613803
Synonyms: 2-({[(3-methylbutyl)amino](oxo)acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylicacid
Smiles: CC(CCNC(=O)C(=O)Nc1sc2c(c1C(=O)O)CCC2)C

STK613806
Synonyms: 1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-phenylthiourea
Smiles: S=C(NC1(C)CCS(=O)(=O)C1)Nc1ccccc1

STK613807
Synonyms: 3-(2-chlorophenyl)-6-(4-ethylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazine
Smiles: CCN1CCN(CC1)c1ccc2n(n1)c(nn2)c1ccccc1Cl

STL036624
Synonyms: 4-[5-(4-bromophenyl)-4-phenyl-1H-imidazol-2-yl]phenol
Smiles: Oc1ccc(cc1)c1nc(c([nH]1)c1ccc(cc1)Br)c1ccccc1

STK613822
Synonyms: {3-[(Z)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1cccc(c1)/C=C\1/C(=NC(=NC1=O)O)O

STK613825
Synonyms: 2-(2-{[(4-chlorophenyl)sulfanyl]methyl}-1H-benzimidazol-1-yl)-N-(ethoxymethyl)-N-(2-ethyl-6-methylphenyl)acetamide
Smiles: CCOCN(c1c(C)cccc1CC)C(=O)Cn1c(CSc2ccc(cc2)Cl)nc2c1cccc2

STK613826
Synonyms: N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl)oxy]acetamide
Smiles: O=C(COc1cc(C)cc2c1c1CCCCc1c(=O)o2)NCCc1c[nH]c2c1cc(F)cc2

STK613828
Synonyms: N-(2-methoxyethyl)-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-amine
Smiles: COCCNc1ncnc2c1sc1c2c(C)cc(n1)C

STK613830
Synonyms: 2-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)CN1CCOCC1)COc1ccc2c(c1)oc(=O)cc2C

STK613831
Synonyms: 5,6-dimethyl-N,7-bis(pyridin-3-ylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: Cc1c(C)n(c2c1c(ncn2)NCc1cccnc1)Cc1cccnc1

STK613834
Synonyms: N-{2-[(4-bromo-2-fluorophenyl)amino]-2-oxoethyl}-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: O=C(Nc1ccc(cc1F)Br)CNC(=O)N1CC(=Nc2c1cccc2)O

STK855408
Synonyms: 1-methyl-2-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-1H-benzimidazol-5-amine
Smiles: Nc1ccc2c(c1)nc(n2C)CCn1ccnc1C

STK613835
Synonyms: 7-(2-methoxyethyl)-5,6-dimethyl-4-(pyrrolidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine
Smiles: COCCn1c(C)c(c2c1ncnc2N1CCCC1)C

STK613837
Synonyms: ethyl5-amino-1-[5,6-dimethyl-7-(2-methylpropyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-3-methyl-1H-pyrazole-4-carboxylate
Smiles: CCOC(=O)c1c(C)nn(c1N)c1ncnc2c1c(C)c(n2CC(C)C)C

STK613838
Synonyms: 2-[(morpholin-4-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylicacid
Smiles: O=C(N1CCOCC1)Nc1sc2c(c1C(=O)O)CCCC2

STK613844
Synonyms: 5-(4-tert-butylbenzyl)-2-(4,6-dimethylpyrimidin-2-yl)-4-hydroxy-6-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: Cc1cc(C)nc(n1)n1[nH]c2c(c1=O)c(O)c(c(n2)C)Cc1ccc(cc1)C(C)(C)C

STK613845
Synonyms: 2-amino-6-hydroxy-5-(3-methoxyphenyl)-3,5-dihydro-4H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: COc1cccc(c1)C1C2=C(O)c3c(C2=Nc2c1c(=O)[nH]c(n2)N)cccc3

STK613855
Synonyms: 2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-7-benzyl-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c(C)c2c(n1Cc1ccccc1)ncn1c2nc(n1)CSc1nc2c(o1)cccc2

STK613856
Synonyms: 1-amino-4-(cyclohexylamino)-2-(4-methylpiperazin-1-yl)anthracene-9,10-dione
Smiles: CN1CCN(CC1)c1cc(NC2CCCCC2)c2c(c1N)C(=O)c1c(C2=O)cccc1

STK613860
Synonyms: 1-(2-methoxyphenyl)-3-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: CCCc1n[nH]/c(=N/C(=O)Nc2ccccc2OC)/s1

STK613866
Synonyms: 2-[6-(2-chlorobenzyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-N-phenylacetamide
Smiles: O=C(Cc1nn2c(n1)nc(c(c2C)Cc1ccccc1Cl)C)Nc1ccccc1

STK613867
Synonyms: N-[2-(2,3-dimethylimidazo[1,2-b][1,2,4]triazin-6-yl)ethyl]-4-methoxy-3-methylbenzenesulfonamide
Smiles: COc1ccc(cc1C)S(=O)(=O)NCCc1cn2c(n1)nc(c(n2)C)C

STK613870
Synonyms: N-(1H-benzimidazol-2-yl)-2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2)Nc1nc2c([nH]1)cccc2

STK613875
Synonyms: N-[2-(1H-indol-3-yl)ethyl]-3-[(5Z)-5-(2-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]propanamide
Smiles: COc1ccccc1/C=C/1\SC(=O)N(C1=O)CCC(=O)NCCc1c[nH]c2c1cccc2

STK613880
Synonyms: 2-{[{[2-(3,4-dimethoxyphenyl)ethyl]amino}(oxo)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylicacid
Smiles: COc1ccc(cc1OC)CCNC(=O)C(=O)Nc1sc2c(c1C(=O)O)CCC2

STK613881
Synonyms: (7Z)-3-(3,4-difluorophenyl)-7-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Smiles: O=C1Nc2c(/C/1=c\1/sc3=NCN(Cn3c1=O)c1ccc(c(c1)F)F)cccc2

STK613882
Synonyms: (2E)-4-(4-hydroxy-3-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)-4-oxobut-2-enoicacid
Smiles: OC(=O)/C=C/C(=O)N1CC(C)C(=Nc2c1cccc2)O

STK613885
Synonyms: methyl2-[({5-chloro-2-[(2-chlorobenzyl)sulfanyl]pyrimidin-4-yl}carbonyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)c1nc(ncc1Cl)SCc1ccccc1Cl

STK613886
Synonyms: 5-[(2-chloro-6-fluorobenzyl)oxy]-2-[4-(2-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]phenol
Smiles: COc1ccccc1c1c(C)noc1c1ccc(cc1O)OCc1c(F)cccc1Cl

STK613889
Synonyms: (6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)(2-phenoxypyridin-3-yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)c1cccnc1Oc1ccccc1

STK613890
Synonyms: 1-{4-[5,6-dimethyl-7-(2-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethanone
Smiles: CC(=O)N1CCN(CC1)c1ncnc2c1c(C)c(n2CCc1ccccc1)C

STK613891
Synonyms: 3-acetyl-2-methyl-1-benzofuran-5-yl4-methylbenzoate
Smiles: Cc1ccc(cc1)C(=O)Oc1ccc2c(c1)c(C(=O)C)c(o2)C

STK613892
Synonyms: 2-[4-(4-bromophenyl)-3-methyl-1H-pyrazol-5-yl]-5-[(2-fluorobenzyl)oxy]phenol
Smiles: Brc1ccc(cc1)c1c(C)n[nH]c1c1ccc(cc1O)OCc1ccccc1F

STK613893
Synonyms: ethyl1-[(7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)methyl]piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2C)O

STK613894
Synonyms: N-(1,3-benzothiazol-2-yl)-2-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(Nc1nc2c(s1)cccc2)COc1ccc2c(c1)oc(=O)cc2C

STK613896
Synonyms: N'-[3-(3,4-dimethoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]-N,N-diethylethane-1,2-diamine
Smiles: CCN(CCNc1cc(C)nc2n1nc(c2c1ccc(c(c1)OC)OC)C)CC

STK613898
Synonyms: N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetamide
Smiles: O=C(COc1cc(C)cc2c1c(C)c(c(=O)o2)C)NCCCN1CCCC1=O

STK613899
Synonyms: 2,7-bis(2-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1c1nc2n(n1)cnc1c2c(C)c(n1c1ccccc1OC)C

STK613900
Synonyms: 5,6-dimethyl-N,7-bis[2-(morpholin-4-yl)ethyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: Cc1n(CCN2CCOCC2)c2c(c1C)c(NCCN1CCOCC1)ncn2

STK613902
Synonyms: 12-(furan-2-yl)-2-[(4-methylphenoxy)methyl]-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: Cc1ccc(cc1)OCc1nc2n(n1)cnc1c2C(c2ccco2)C2=C(O1)CCCC2=O

STK613906
Synonyms: 3-(3,4-dimethoxyphenyl)-3-{[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}propanoicacid
Smiles: COc1cc(ccc1OC)C(CC(=O)O)NC=C1C(=O)N(C)C(=O)N(C1=O)C

STK613907
Synonyms: 4-({4-[(Z)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]-2-methoxyphenoxy}methyl)benzoicacid
Smiles: COc1cc(ccc1OCc1ccc(cc1)C(=O)O)/C=C\1/C(=NC(=NC1=O)O)O

STK613910
Synonyms: ethyl{1-[2-(dimethylamino)ethyl]-6,6-dimethyl-2,4-dioxo-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl}acetate
Smiles: CCOC(=O)Cn1c(=O)c2c3CC(C)(C)OCc3sc2n(c1=O)CCN(C)C

STK613912
Synonyms: 2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Smiles: O=C(COc1ccc2c(c1C)oc(=O)cc2C)NCCc1ccc(cc1)S(=O)(=O)N

STK613913
Synonyms: {2-bromo-4-[(E)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccc(cc1Br)/C=C/1\C(=NC(=NC1=O)O)O

STK613914
Synonyms: 2-{2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl}-N,N-dimethylethanamine
Smiles: CN(CCn1c2ncn3c(c2c(c1C)C)nc(n3)CSc1nc2c(s1)cccc2)C

STK855418
Synonyms: N-{1-methyl-2-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-1H-benzimidazol-5-yl}butanamide
Smiles: CCCC(=O)Nc1ccc2c(c1)nc(n2C)CCn1ccnc1C

STK613917
Synonyms: 2-{(5Z)-2,4-dioxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-1,3-thiazolidin-3-yl}-N-(2-oxo-2H-chromen-6-yl)acetamide
Smiles: O=C(CN1C(=O)S/C(=C\C=C\c2ccccc2)/C1=O)Nc1ccc2c(c1)ccc(=O)o2

STK613918
Synonyms: N-({4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)glycine
Smiles: CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)NCC(=O)O

STK613919
Synonyms: 3-{2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxoethyl}-7-hydroxy-4-methyl-2H-chromen-2-one
Smiles: Oc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK613921
Synonyms: 5-[(2-chlorobenzyl)oxy]-2-[5-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]phenol
Smiles: COc1cc(ccc1OC)c1c(ncnc1C(F)(F)F)c1ccc(cc1O)OCc1ccccc1Cl

STK613922
Synonyms: 9-(propylsulfanyl)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclohexan]-7-ol
Smiles: CCCSc1nnc2n1c(O)c1c(n2)c2ccccc2CC21CCCCC2

STK613923
Synonyms: N-{3-[(2-fluorobenzyl)amino]-3-oxopropyl}-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: O=C(NCc1ccccc1F)CCNC(=O)N1CC(=Nc2c1cccc2)O

STK855419
Synonyms: 2-(3-methoxyphenyl)-5-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1cccs1)c1cccc(c1)OC

STK613928
Synonyms: 5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-chloro-2-(1-methyl-1H-benzimidazol-2-yl)pyridazin-3(2H)-one
Smiles: Clc1c(cnn(c1=O)c1nc2c(n1C)cccc2)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK613933
Synonyms: 1-[4-(7,9-dimethylpyrido[3',2':4,5]furo[3,2-d]pyrimidin-4-yl)piperazin-1-yl]-2-methylpropan-1-one
Smiles: O=C(N1CCN(CC1)c1ncnc2c1oc1c2c(C)cc(n1)C)C(C)C

STK613935
Synonyms: 2-({[4-(2-hydroxyethyl)piperazin-1-yl](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxamide
Smiles: OCCN1CCN(CC1)C(=O)C(=O)Nc1sc2c(c1C(=O)N)CC(OC2)(C)C

STK613936
Synonyms: (E)-1-(4-chlorophenyl)-N-{[7-(2-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}methanimine
Smiles: COc1ccccc1n1c(C)c(c2c1ncn1c2nc(n1)CO/N=C/c1ccc(cc1)Cl)C

STK613939
Synonyms: 2-(phenoxymethyl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: CCCc1cc(O)n2c(n1)c(c1ccccc1)c(n2)COc1ccccc1

STK613941
Synonyms: 3-(4-aminophenyl)-1H-pyrazole-5-carboxylicacid
Smiles: Nc1ccc(cc1)c1n[nH]c(c1)C(=O)O

STK613942
Synonyms: 7-[2-(4-ethylpiperazin-1-yl)ethoxy]-3-phenyl-4H-chromen-4-one
Smiles: CCN1CCN(CC1)CCOc1ccc2c(c1)occ(c2=O)c1ccccc1

STK613943
Synonyms: 8,9-dimethyl-2-phenyl-7-(pyridin-4-ylmethyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1n(Cc2ccncc2)c2c(c1C)c1nc(nn1cn2)c1ccccc1

STK613946
Synonyms: 6-{[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]carbonyl}-1,4-dihydroquinoxaline-2,3-dione
Smiles: O=C(c1ccc2c(c1)[nH]c(=O)c(=O)[nH]2)N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)OCCO2

STK855422
Synonyms: 1,7,7-trimethyl-4-[(4-phenylpiperazin-1-yl)carbonyl]bicyclo[2.2.1]heptane-2,3-dione
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)N1CCN(CC1)c1ccccc1

STK613951
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-methyl-2-[(2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)C)COc1ccc2c(c1)oc(=O)cc2

STK613952
Synonyms: 2-(4-chlorophenoxy)-N-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]acetamide
Smiles: O=C(Nc1nnc(s1)S(=O)(=O)C)COc1ccc(cc1)Cl

STK613954
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-{(5Z)-2,4-dioxo-5-[(2E)-3-phenylprop-2-en-1-ylidene]-1,3-thiazolidin-3-yl}-N-ethylacetamide
Smiles: CCN(C1CCS(=O)(=O)C1)C(=O)CN1C(=O)S/C(=C\C=C\c2ccccc2)/C1=O

STK613956
Synonyms: 16-(4-fluorophenyl)-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: Fc1ccc(cc1)C1C=C2N(C3=C1C(=O)CCC3)CCc1c2cc2OCCCOc2c1

STK613958
Synonyms: N'-{(E)-[3-(4-bromobenzyl)-4-chloro-2-oxo-2,3-dihydro-1,3-thiazol-5-yl]methylidene}-2-phenylacetohydrazide
Smiles: O=C(Cc1ccccc1)N/N=C/c1sc(=O)n(c1Cl)Cc1ccc(cc1)Br

STK613959
Synonyms: 3-(3-chloro-1,2-oxazol-5-yl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
Smiles: O=C(Nc1ncc(s1)C)CCc1onc(c1)Cl

STK613965
Synonyms: N-[7,7-dimethyl-2-(methylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]ethane-1,2-diamine
Smiles: NCCNc1nc(SC)nc2c1sc1c2COC(C1)(C)C

STK855424
Synonyms: 6-(4-chlorobenzyl)-3-[(3-hydroxypropyl)amino]-1,2,4-triazin-5-ol
Smiles: OCCCNc1nnc(c(n1)O)Cc1ccc(cc1)Cl

STK613970
Synonyms: 5-{2-[4-(4-fluorophenyl)piperazin-1-yl]ethoxy}-2-(3-methyl-4-phenyl-1H-pyrazol-5-yl)phenol
Smiles: Fc1ccc(cc1)N1CCN(CC1)CCOc1ccc(c(c1)O)c1[nH]nc(c1c1ccccc1)C

STK613972
Synonyms: 4-{[(2Z)-4,5-diphenyl-1,3-thiazol-2(3H)-ylidene]amino}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)/N=c/1\sc(c([nH]1)c1ccccc1)c1ccccc1

STK613976
Synonyms: 2-(4-{5-[(4-hydroxy-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)carbonyl]-4,5-dihydro-1,2-oxazol-3-yl}phenoxy)acetamide
Smiles: NC(=O)COc1ccc(cc1)C1=NOC(C1)C(=O)N1C(C)CC(=Nc2c1cccc2)O

STK613984
Synonyms: methyl(1-benzyl-2,4-dioxo-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)acetate
Smiles: COC(=O)Cn1c(=O)c2c3CCCc3sc2n(c1=O)Cc1ccccc1

STK613985
Synonyms: 1-(3-methoxyphenyl)-3-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: COc1cccc(c1)NC(=O)/N=c\1/[nH]nc(s1)C

STK613987
Synonyms: N-[2-([1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl]naphthalene-2-sulfonamide
Smiles: O=S(=O)(c1ccc2c(c1)cccc2)NCCc1csc2n1ncn2

STK855425
Synonyms: 1-(benzyloxy)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-2-ol
Smiles: OC(Cn1nc(cc1C)C)COCc1ccccc1

STK613992
Synonyms: 4-(4-methoxyphenyl)-9-(propan-2-yl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1ccc1c2CN(CO1)C(C)C

STK613993
Synonyms: (3Z)-3-(2-methylpropylidene)-1-phenylpyrrolidine-2,5-dione
Smiles: CC(/C=C\1/CC(=O)N(C1=O)c1ccccc1)C

STK613996
Synonyms: 2-[4-(3,4-dimethoxyphenyl)-3-methyl-1H-pyrazol-5-yl]-5-[(4-fluorobenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1c(C)n[nH]c1c1ccc(cc1O)OCc1ccc(cc1)F

STK614006
Synonyms: 2-(3,4-dimethoxyphenyl)-5-{4-[(3-methoxyphenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: COc1cccc(c1)C(=O)N1CCN(CC1)c1oc(nc1C#N)c1ccc(c(c1)OC)OC

STK614008
Synonyms: 6-benzyl-3-{[2-(3H-indol-3-yl)ethyl]amino}-1,2,4-triazin-5-ol
Smiles: Oc1nc(NCCC2C=Nc3c2cccc3)nnc1Cc1ccccc1

STK614010
Synonyms: 2-[2-amino-5-(2-methoxyphenyl)pyrimidin-4-yl]-5-[(3-chlorobenzyl)oxy]phenol
Smiles: COc1ccccc1c1cnc(nc1c1ccc(cc1O)OCc1cccc(c1)Cl)N

STK614011
Synonyms: 2-hydroxy-3-{[(E)-(4-hydroxyphenyl)methylidene]amino}quinazolin-4(3H)-one
Smiles: Oc1ccc(cc1)/C=N/n1c(O)nc2c(c1=O)cccc2

STK614012
Synonyms: 7-(azepan-1-yl)-6-benzyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Smiles: O=c1c(Cc2ccccc2)c(nc2n1CCS2)N1CCCCCC1

STK855427
Synonyms: 2-(2-chlorophenoxy)-N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide
Smiles: COc1cc(ccc1OC)c1nonc1NC(=O)C(Oc1ccccc1Cl)C

STK614015
Synonyms: 3-amino-2-(3-methoxyphenyl)-1-oxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(N)n(c2cccc(c2)OC)c(=O)c2c1CCCC2

STK614017
Synonyms: 3-{[7-(3-methoxypropyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}propan-1-ol
Smiles: COCCCn1c(C)c(c2c1ncnc2NCCCO)C

STK614018
Synonyms: N-cycloheptyl-2-(5-hydroxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(O)cc(c2)C)NC1CCCCCC1

STK614022
Synonyms: N-[(2S)-1-[(4-methoxybenzyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: CSCC[C@@H](C(=O)NCc1ccc(cc1)OC)NC(=O)N1CCn2c1nc1c2cccc1

STK614025
Synonyms: 2-{[{[2-(morpholin-4-yl)ethyl]amino}(oxo)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylicacid
Smiles: O=C(C(=O)Nc1sc2c(c1C(=O)O)CCC2)NCCN1CCOCC1

STK614027
Synonyms: 4-[2-(4-methylphenyl)-2-oxoethyl]-2-phenyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: Cc1ccc(cc1)C(=O)CN1C(=O)C(Oc2c(C1=O)cccc2)c1ccccc1

STK614029
Synonyms: N-{2-[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]ethyl}-2-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)CC(=O)NCCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK614030
Synonyms: 1,3-dimethyl-2-thioxo-5-({[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]amino}methylidene)dihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=S)N(C)C(=O)C(=CNc2ccc(cc2)Cn2ncnc2)C1=O

STK855430
Synonyms: 2-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-(4-chlorophenyl)acetamide
Smiles: O=C(Cc1nc2n(n1)c(C)c(c(n2)C)Cl)Nc1ccc(cc1)Cl

STK614031
Synonyms: 5,6-dimethyl-7-[2-(morpholin-4-yl)ethyl]-3-(1,3-thiazol-2-yl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1c(C)n(c2c1c(=N)n(cn2)c1nccs1)CCN1CCOCC1

STK614032
Synonyms: 2-{4-[4-cyano-1-(2-methylpropyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl]piperazin-1-yl}-N-(1,3-thiazol-2-yl)acetamide
Smiles: N#Cc1c(nc(c2c1CCC2)CC(C)C)N1CCN(CC1)CC(=O)Nc1nccs1

STK614033
Synonyms: methyl2-{[bis(2-hydroxyethyl)carbamoyl]amino}-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: OCCN(C(=O)Nc1sc2c(c1C(=O)OC)CC(OC2)(C)C)CCO

STK614039
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methyl)furan-2-carboxamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)Cc1ccc(o1)c1cccc(c1)C(F)(F)F)c1ccco1

STK614040
Synonyms: 7,9-dimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: Cc1cc(C)c2c(n1)sc1c2ncnc1N1CCN(CC1)c1ccccn1

STK614045
Synonyms: 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Smiles: O=C(CCc1c(=O)oc2c(c1C)ccc(c2C)O)NCCc1ccc(cc1)S(=O)(=O)N

STK614047
Synonyms: 6-(4-chlorobenzyl)-3-[(pyridin-3-ylmethyl)amino]-1,2,4-triazin-5-ol
Smiles: Clc1ccc(cc1)Cc1nnc(nc1O)NCc1cccnc1

STK614051
Synonyms: N-{2-[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]ethyl}furan-2-carboxamide
Smiles: Clc1cc(c2n(c1)c(CCNC(=O)c1ccco1)nn2)C(F)(F)F

STK614052
Synonyms: [1-({[(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]amino}methyl)cyclohexyl]aceticacid
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)NCC1(CCCCC1)CC(=O)O

STK614054
Synonyms: 2-[4-(3,4-dimethoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-5-[(4-nitrobenzyl)oxy]phenol
Smiles: COc1ccc(cc1OC)c1c(C)noc1c1ccc(cc1O)OCc1ccc(cc1)[N+](=O)[O-]

STK614055
Synonyms: methyl2-[({6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridin-3-yl}carbonyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)N

STK614056
Synonyms: 4-(piperidin-1-ylsulfonyl)-N-[3-(1H-tetrazol-1-yl)phenyl]benzamide
Smiles: O=C(c1ccc(cc1)S(=O)(=O)N1CCCCC1)Nc1cccc(c1)n1cnnn1

STK855435
Synonyms: 3-cyclohexyl-2-hydroxy-3,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one
Smiles: Oc1nc2CCCc2c(=O)n1C1CCCCC1

STK614059
Synonyms: 2-{(5Z)-2,4-dioxo-5-[4-(propan-2-yl)benzylidene]-1,3-thiazolidin-3-yl}-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]acetamide
Smiles: OCC(Cc1ccccc1)NC(=O)CN1C(=O)S/C(=C\c2ccc(cc2)C(C)C)/C1=O

STK614060
Synonyms: 2-{[2-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-d]pyrimidin-4-yl]sulfanyl}ethanol
Smiles: OCCSc1nc(SC)nc2c1sc1c2CCCC1

STK614061
Synonyms: {2,4-dioxo-1-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl}aceticacid
Smiles: O=C(Cn1c(=O)n(CC(=O)O)c(=O)c2c1sc1c2CCCC1)Nc1nccs1

STK614067
Synonyms: 5-[(2-chloro-4-fluorobenzyl)oxy]-2-[4-(3,4-dimethoxyphenyl)-3-methyl-1,2-oxazol-5-yl]phenol
Smiles: COc1cc(ccc1OC)c1c(C)noc1c1ccc(cc1O)OCc1ccc(cc1Cl)F

STK614069
Synonyms: 4-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[3-(1H-imidazol-1-yl)propyl]butanamide
Smiles: O=C(NCCCn1cncc1)CCCN1C(=S)S/C(=C\c2ccc(cc2)F)/C1=O

STK614074
Synonyms: 4-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: COc1cc(cc(c1O)OC)C1CC(=O)Nc2c1c(O)nc(n2)c1ccccc1

STK614078
Synonyms: N-[4-({[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}sulfamoyl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)NCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK614080
Synonyms: 2-(furan-2-yl)-8,9-dimethyl-7-(pyridin-4-ylmethyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c(C)n(c2c1c1nc(nn1cn2)c1ccco1)Cc1ccncc1

STK855439
Synonyms: N-[2-(6-ethyl-2-oxo-2H-chromen-4-yl)-1-benzofuran-3-yl]furan-2-carboxamide
Smiles: CCc1ccc2c(c1)c(cc(=O)o2)c1oc2c(c1NC(=O)c1ccco1)cccc2

STK614082
Synonyms: (3S)-N-{2-[(3-methylphenyl)amino]-2-oxoethyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C(Nc1cccc(c1)C)CNC(=O)[C@H]1NCc2c(C1)cccc2

STK614083
Synonyms: 1-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-3-[3-(dimethylamino)propyl]urea
Smiles: N#Cc1c(NC(=O)NCCCN(C)C)sc2c1CC(C)(C)OC2

STK614084
Synonyms: N-(3-chloro-4-{4-[(1-methyl-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}phenyl)furan-2-carboxamide
Smiles: Clc1cc(ccc1N1CCN(CC1)Cc1nc2c(n1C)cccc2)NC(=O)c1ccco1

STK614087
Synonyms: 2-({[(2-methoxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylicacid
Smiles: COCCNC(=O)C(=O)Nc1sc2c(c1C(=O)O)CC(OC2)(C)C

STK614089
Synonyms: 5-chloro-2-(methylsulfanyl)-N-[4-(propan-2-yl)phenyl]pyrimidine-4-carboxamide
Smiles: CSc1ncc(c(n1)C(=O)Nc1ccc(cc1)C(C)C)Cl

STK614092
Synonyms: 3,7-bis(chloroacetyl)-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Smiles: ClCC(=O)N1CC2(C)CN(CC(C1)(C2=O)C)C(=O)CCl

STK855440
Synonyms: 2-(4-fluorophenyl)-5-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccco1)c1ccc(cc1)F

STK614094
Synonyms: 2,3,5,9-tetramethyl-6-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-7H-furo[3,2-g]chromen-7-one
Smiles: CN1CCN(CC1)C(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C

STK614096
Synonyms: 5-ethyl-2,3-diphenylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: CCc1cc(O)n2c(n1)c(c1ccccc1)c(n2)c1ccccc1

STK614102
Synonyms: 1,3-benzodioxol-5-yl[2-(3,4-dimethoxyphenyl)-6,7-dihydro[1,3]thiazolo[5,4-c]pyridin-5(4H)-yl]methanone
Smiles: COc1cc(ccc1OC)c1nc2c(s1)CN(CC2)C(=O)c1ccc2c(c1)OCO2

STK614106
Synonyms: 5'-(4-fluorophenyl)-2',4'-dihydrospiro[indole-3,3'-pyrazol]-2(1H)-one
Smiles: Fc1ccc(cc1)C1=NNC2(C1)C(=O)Nc1c2cccc1

STK614109
Synonyms: 2-(4-chloro-3-methylphenoxy)-N-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]propanamide
Smiles: O=C(C(Oc1ccc(c(c1)C)Cl)C)Nc1nnc(s1)S(=O)(=O)C

STK855442
Synonyms: (2E)-3-(4-methoxyphenyl)-N-(9-oxo-9H-xanthen-3-yl)prop-2-enamide
Smiles: COc1ccc(cc1)/C=C/C(=O)Nc1ccc2c(c1)oc1c(c2=O)cccc1

STK614111
Synonyms: 3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-oxo-2H-chromen-7-yl3-methoxybenzoate
Smiles: COc1cccc(c1)C(=O)Oc1ccc2c(c1)oc(=O)c(c2)c1scc(n1)c1ccc(cc1)Br

STK614113
Synonyms: 7-benzyl-2,8,9-trimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1n(Cc2ccccc2)c2c(c1C)c1nc(nn1cn2)C

STK614115
Synonyms: (5Z)-6-hydroxy-3-(3-methoxypropyl)-5-{[(5-methyl-1,2-oxazol-3-yl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C/Nc2noc(c2)C)/C1=O)O

STK614116
Synonyms: N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(1-methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)ethanediamide
Smiles: O=C(C(=O)NCc1cnn(c1C)C)NC1c2ccccc2N(C1=O)C

STK614120
Synonyms: 2-(3,4-dimethoxyphenyl)-N-(3-methoxybenzyl)-4-methyl-1,3-thiazole-5-carboxamide
Smiles: COc1cccc(c1)CNC(=O)c1sc(nc1C)c1ccc(c(c1)OC)OC

STK614124
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-N~2~-[(2,4,6-trimethylphenyl)sulfonyl]glycinamide
Smiles: O=C(CNS(=O)(=O)c1c(C)cc(cc1C)C)NCc1cc(=O)n(c(=O)n1C)C

STK614128
Synonyms: 2-(1H-benzimidazol-2-yl)-4-ethyl-5-methyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CCc1c(C)[nH]n(c1=O)c1nc2c([nH]1)cccc2

STK614129
Synonyms: 2-[(5,5-dioxido-1-phenyl-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl)sulfanyl]-N,N-dimethylacetamide
Smiles: CN(C(=O)CSC1=NC2C(N1c1ccccc1)CS(=O)(=O)C2)C

STK614133
Synonyms: 2-[(2-methoxyethyl)sulfanyl]-1-(2-methoxyphenyl)-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole5,5-dioxide
Smiles: COCCSC1=NC2C(N1c1ccccc1OC)CS(=O)(=O)C2

STK614134
Synonyms: 2-{[5,6-dimethyl-7-(2-methylpropyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}ethanol
Smiles: OCCNc1ncnc2c1c(C)c(n2CC(C)C)C

STK614136
Synonyms: N-(2-methoxyphenyl)-5-methyl-7-(2-methylpropyl)-2-(methylsulfanyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: COc1ccccc1NC(=O)C1=C(C)N=c2n(C1CC(C)C)nc([nH]2)SC

STK614138
Synonyms: 2-benzyl-8,9-dimethyl-7-(pyridin-3-ylmethyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c(C)c2c(n1Cc1cccnc1)ncn1c2nc(n1)Cc1ccccc1

STK855446
Synonyms: 7,8-dimethyl-4-oxo-N-(4-sulfamoylphenyl)-4H-chromene-2-carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)c(C)c(cc2)C)Nc1ccc(cc1)S(=O)(=O)N

STK614139
Synonyms: N-(2-methoxybenzyl)-3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxamide
Smiles: COc1ccccc1CNC(=O)c1cccc2c1oc(c1ccccc1)c(c2=O)C

STK614140
Synonyms: methyl4-[(7Z)-7-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)/c(=C\1/C(=O)Nc3c1cc(F)cc3)/s2

STK855447
Synonyms: 3-[(3-methoxyphenyl)amino]-1,2,4-triazin-5-ol
Smiles: COc1cccc(c1)Nc1nncc(n1)O

STK614144
Synonyms: ethyl3-{6,10-dimethyl-3-[3-(morpholin-4-yl)propyl]-8-oxo-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-7-yl}propanoate
Smiles: CCOC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)OCN(C1)CCCN1CCOCC1

STK855448
Synonyms: 5-benzyl-6-methyl-2-(propylsulfanyl)pyrimidin-4-ol
Smiles: CCCSc1nc(C)c(c(n1)O)Cc1ccccc1

STK614145
Synonyms: N-[1-(1H-indol-3-yl)propan-2-yl]-N'-(quinolin-5-yl)ethanediamide
Smiles: CC(Cc1c[nH]c2c1cccc2)NC(=O)C(=O)Nc1cccc2c1cccn2

STK614150
Synonyms: (E)-1-(4-chlorophenyl)-N-{[8,9-dimethyl-7-(6-methylpyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}methanimine
Smiles: Clc1ccc(cc1)/C=N/OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1cccc(n1)C

STK614159
Synonyms: 2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-cyclopropylacetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)NC1CC1

STK614160
Synonyms: (5Z)-5-[5-(2,5-dimethoxyphenyl)pyrazolidin-3-ylidene]-6-hydroxy-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C\2/NNC(C2)c2cc(OC)ccc2OC)/C1=O)O

STK614164
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-2-[(5Z)-5-(4-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: CCN(C1CCS(=O)(=O)C1)C(=O)CN1C(=O)S/C(=C\c2ccc(cc2)OC)/C1=O

STK614167
Synonyms: 5,6-dimethyl-7-[3-(morpholin-4-yl)propyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: Nc1ncnc2c1c(C)c(n2CCCN1CCOCC1)C

STK855450
Synonyms: 1-{4-[(6-chloro-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]phenyl}ethanone
Smiles: CC(=O)c1ccc(cc1)Nc1c(Cl)c(C)nc2n1ncn2

STK614169
Synonyms: N-[3-(1H-benzimidazol-2-yl)-1-(2-methoxyethyl)-4,5-dimethyl-1H-pyrrol-2-yl]thiophene-2-carboxamide
Smiles: COCCn1c(C)c(c(c1NC(=O)c1cccs1)c1nc2c([nH]1)cccc2)C

STK614175
Synonyms: 3-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1-(piperidin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCC(=O)N2CCCC2)nc(c2c1CCCC2)N1CCCCC1

STK614178
Synonyms: 5,6-dimethyl-7-(pyridin-2-yl)-3-(pyridin-3-ylmethyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1n(c2ccccn2)c2c(c1C)c(=N)n(cn2)Cc1cccnc1

STK614179
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-Nalpha-[(4-methoxyphenyl)sulfonyl]phenylalaninamide
Smiles: COc1ccc(cc1)S(=O)(=O)NC(C(=O)NCc1cc(=O)n(c(=O)n1C)C)Cc1ccccc1

STK855452
Synonyms: N-(5-fluoro-9-oxo-9H-xanthen-3-yl)-2-(4-fluorophenoxy)acetamide
Smiles: O=C(Nc1ccc2c(c1)oc1c(c2=O)cccc1F)COc1ccc(cc1)F

STK614182
Synonyms: 6-(3,4-dimethoxybenzyl)-3-[(4-fluorophenyl)amino]-1,2,4-triazin-5-ol
Smiles: COc1cc(ccc1OC)Cc1nnc(nc1O)Nc1ccc(cc1)F

STK614186
Synonyms: 3-(3,4-dimethoxyphenyl)-2,5-dimethyl-7-[4-(pyridin-2-yl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)cc2N1CCN(CC1)c1ccccn1

STK855453
Synonyms: 2-(3-chlorophenyl)-5-{4-[(3-methoxyphenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1cccc(c1)OC)c1cccc(c1)Cl

STK614189
Synonyms: (5Z)-5-{[1-(2,3-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-4-hydroxy-1,3-thiazol-2(5H)-one
Smiles: O=C1N=C(/C(=C/c2cc(n(c2C)c2cccc(c2C)C)C)/S1)O

STK614190
Synonyms: 2-[(6-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-[3-(1H-imidazol-1-yl)propyl]acetamide
Smiles: O=C(COc1cc2oc(=O)cc(c2cc1Cl)C)NCCCn1cncc1

STK614194
Synonyms: 1-aminotetrahydro-1H-thieno[3,4-d]imidazole-2(3H)-thione5,5-dioxide
Smiles: NN1C(=S)NC2C1CS(=O)(=O)C2

STK614195
Synonyms: 6-(4-chlorobenzyl)-3-[(tetrahydrofuran-2-ylmethyl)amino]-1,2,4-triazin-5-ol
Smiles: Clc1ccc(cc1)Cc1nnc(nc1O)NCC1CCCO1

STK855457
Synonyms: 1-{(E)-2-[(4-chlorophenyl)sulfonyl]-2-cyanoethenyl}piperidine-4-carboxamide
Smiles: N#C/C(=C\N1CCC(CC1)C(=O)N)/S(=O)(=O)c1ccc(cc1)Cl

STK614202
Synonyms: 2-({4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]-2-ethoxyphenoxy}methyl)benzonitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1C#N)/C=C/c1nc(O)nc(c1[N+](=O)[O-])O

STK614203
Synonyms: {1-[({(Z)-[1-(4-chlorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}amino)methyl]cyclohexyl}aceticacid
Smiles: OC(=O)CC1(CCCCC1)CN/C=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O

STK614205
Synonyms: (5Z)-5-{[4-bromo-5-(morpholin-4-yl)furan-2-yl]methylidene}-1-(2-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\c1oc(c(c1)Br)N1CCOCC1)c1ccccc1F

STK614212
Synonyms: 1-({6-chloro-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)piperidine-3-carboxylicacid
Smiles: CC(=C)COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)N1CCCC(C1)C(=O)O

STK614213
Synonyms: 2,5-dimethyl-3-phenyl-7-[4-(pyridin-2-yl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine
Smiles: Cc1cc(N2CCN(CC2)c2ccccn2)n2c(n1)c(c1ccccc1)c(n2)C

STK614215
Synonyms: 3-(8,9-dimethyl-2-phenyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl)-N,N-dimethylpropan-1-amine
Smiles: CN(CCCn1c(C)c(c2c1ncn1c2nc(n1)c1ccccc1)C)C

STK614218
Synonyms: N-(2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-1-ylcarbonyl)-L-methionyl-D-alanine
Smiles: CSCC[C@@H](C(=O)N[C@@H](C(=O)O)C)NC(=O)N1CCn2c1nc1c2cccc1

STK614219
Synonyms: 2-(4-chlorophenyl)-8,9-dimethyl-7-[2-(morpholin-4-yl)ethyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccc(cc1)c1nn2c(n1)c1c(nc2)n(c(c1C)C)CCN1CCOCC1

STK614225
Synonyms: N-(1H-benzimidazol-2-yl)-2-[(4-butyl-6-chloro-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)Nc1nc2c([nH]1)cccc2

STK614228
Synonyms: 1-(2-chlorobenzyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Smiles: COc1cc(CCNc2ncnc3c2cnn3Cc2ccccc2Cl)ccc1OC

STK614229
Synonyms: (2E)-3-(2-chlorophenyl)-N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}prop-2-enamide
Smiles: O=C(NCc1nnc2n1cc(Cl)cc2C(F)(F)F)/C=C/c1ccccc1Cl

STK614231
Synonyms: 6-oxo-1-phenyl-N-[(2E)-4,5,6,7-tetrahydro-1,3-benzothiazol-2(3H)-ylidene]-1,4,5,6-tetrahydropyridazine-3-carboxamide
Smiles: O=C1CCC(=NN1c1ccccc1)C(=O)/N=c\1/sc2c([nH]1)CCCC2

STK614233
Synonyms: 1-[(5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)carbonyl]piperidine-4-carboxylicacid
Smiles: CCn1cc(C(=O)N2CCC(CC2)C(=O)O)c(=O)c2c1cc1OCOc1c2

STK614235
Synonyms: 6-(3,4-dimethoxybenzyl)-3-[(4-ethylphenyl)amino]-1,2,4-triazin-5-ol
Smiles: CCc1ccc(cc1)Nc1nnc(c(n1)O)Cc1ccc(c(c1)OC)OC

STK614236
Synonyms: N-{3-[(furan-2-ylmethyl)amino]-3-oxopropyl}-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: O=C(NCc1ccco1)CCNC(=O)N1CC(=Nc2c1cccc2)O

STK614240
Synonyms: 4-methyl-3-{[1-(4-phenylpiperazin-1-yl)-1-thioxopropan-2-yl]oxy}-6H-benzo[c]chromene-6-thione
Smiles: CC(C(=S)N1CCN(CC1)c1ccccc1)Oc1ccc2c(c1C)oc(=S)c1c2cccc1

STK614241
Synonyms: 2-[(4Z)-4-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-3-oxo-1-phenylbutan-2-yl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(C(N1C(=O)c2c(C1=O)cccc2)Cc1ccccc1)/C=C/1\NCCc2c1cc1OCOc1c2

STK614243
Synonyms: N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3,5-dimethyl-1-benzofuran-2-carboxamide
Smiles: CN(C(c1ccco1)CNC(=O)c1oc2c(c1C)cc(cc2)C)C

STK614244
Synonyms: (E)-N-({7-[2-(3,4-dimethoxyphenyl)ethyl]-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl}methoxy)-1-phenylmethanimine
Smiles: COc1cc(ccc1OC)CCn1c(C)c(c2c1ncn1c2nc(n1)CO/N=C/c1ccccc1)C

STK614246
Synonyms: N-[4-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)butanoyl]glycine
Smiles: O=C(NCC(=O)O)CCCn1c(O)nc2c(c1=O)cccc2

STK855460
Synonyms: 7-hydroxy-4-methyl-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2H-chromen-2-one
Smiles: Oc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCCC1

STK614249
Synonyms: N-(1,3-benzothiazol-2-yl)-5-chloro-2-(methylsulfonyl)pyrimidine-4-carboxamide
Smiles: O=C(c1nc(ncc1Cl)S(=O)(=O)C)Nc1nc2c(s1)cccc2

STK614251
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-[(5Z)-2,4-dioxo-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-methylpropanamide
Smiles: CN(C1CCS(=O)(=O)C1)C(=O)CCN1C(=O)S/C(=C\c2cccs2)/C1=O

STK614253
Synonyms: (5Z)-5-benzylidene-3-{6-[2-(2-hydroxyethyl)piperidin-1-yl]-6-oxohexyl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: OCCC1CCCCN1C(=O)CCCCCN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK614257
Synonyms: N-[4-(4-fluorophenyl)-1,2,5-oxadiazol-3-yl]-2-methylpropanamide
Smiles: O=C(C(C)C)Nc1nonc1c1ccc(cc1)F

STK614258
Synonyms: 2-(2-chlorophenyl)-8,9-dimethyl-7-[2-(morpholin-4-yl)ethyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccccc1c1nn2c(n1)c1c(nc2)n(c(c1C)C)CCN1CCOCC1

STK614259
Synonyms: 5-amino-3-({[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]methyl}sulfanyl)[1,2,4]triazolo[4,3-a]pyrimidin-7-ol
Smiles: Cc1ccc(c(c1)C)n1nnnc1CSc1nnc2n1c(N)cc(n2)O

STK614261
Synonyms: 2-(2-methoxyphenyl)-8,9-dimethyl-7-(2-methylpropyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1c1nn2c(n1)c1c(nc2)n(c(c1C)C)CC(C)C

STK614262
Synonyms: N-cyclopropyl-2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(NC1CC1)COc1cc(O)c2c(c1)OC(CC2=O)(C)C

STK614263
Synonyms: 4-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)-2-methyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: COc1cc(cc(c1O)OC)C1CC(=O)Nc2c1c(O)nc(n2)C

STK614265
Synonyms: 5-ethyl-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: CCc1cc(O)n2c(n1)c(c1ccccc1)c(n2)C

STK614268
Synonyms: 1-{[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonyl}-N-[(2S)-1-oxo-1-(pyrrolidin-1-yl)propan-2-yl]piperidine-4-carboxamide
Smiles: C[C@@H](C(=O)N1CCCC1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)N1CCCC1=O

STK614270
Synonyms: 2-[(7,9-dimethylpyrido[3',2':4,5]furo[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(morpholin-4-yl)ethanone
Smiles: O=C(N1CCOCC1)CSc1ncnc2c1oc1c2c(C)cc(n1)C

STK614271
Synonyms: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-N'-(3-methylbutyl)ethanediamide
Smiles: CC(CCNC(=O)C(=O)Nc1sc2c(c1C(=O)N)CC(OC2)(C)C)C

STK855462
Synonyms: (5E)-6-hydroxy-3-(4-methylphenyl)-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: C#CCn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)C)O

STK614280
Synonyms: 3-(3,4-dimethoxyphenyl)-7-[2-(4-phenylpiperazin-1-yl)ethoxy]-2H-chromen-2-one
Smiles: COc1cc(ccc1OC)c1cc2ccc(cc2oc1=O)OCCN1CCN(CC1)c1ccccc1

STK614283
Synonyms: 5,6-dimethyl-7-(pyridin-3-yl)-N-(pyridin-3-ylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: Cc1n(c2cccnc2)c2c(c1C)c(ncn2)NCc1cccnc1

STK614286
Synonyms: 5-(3,4-dimethoxyphenyl)-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: COc1cc(ccc1OC)c1cc(O)n2c(n1)nc(n2)SC

STK614288
Synonyms: 4-chloro-N-{2-[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]ethyl}benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)NCCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK614290
Synonyms: 4-hydroxy-2-phenyl-5-[4-(trifluoromethyl)phenyl]-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C1Nc2nc(nc(c2C(C1)c1ccc(cc1)C(F)(F)F)O)c1ccccc1

STK614292
Synonyms: 3,3-dimethyl-8-(2-methylpropyl)-6-{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(nc(c2c1CC(C)(C)OC2)CC(C)C)N1CCN(CC1)CC(=O)N1CCOCC1

STK614296
Synonyms: N-(furan-2-ylmethyl)-7,9-dimethylpyrido[3',2':4,5]furo[3,2-d]pyrimidin-4-amine
Smiles: Cc1cc(C)c2c(n1)oc1c2ncnc1NCc1ccco1

STK614299
Synonyms: 3-benzyl-7-(2-methoxyphenyl)-5,6-dimethyl-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: COc1ccccc1n1c2ncn(c(=N)c2c(c1C)C)Cc1ccccc1

STK614301
Synonyms: 2-cyclohexyl-5-(3,4-dimethylphenyl)-4-phenyl-1H-imidazole
Smiles: Cc1cc(ccc1C)c1[nH]c(nc1c1ccccc1)C1CCCCC1

STK614302
Synonyms: (2E)-3-(3,4-dimethoxyphenyl)-N-[2-(2-phenyl-1H-imidazol-5-yl)ethyl]prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)NCCc2cnc([nH]2)c2ccccc2)ccc1OC

STK614304
Synonyms: 2-(morpholin-4-yl)-N-[(2E)-6-nitro-1,3-benzothiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=c\1/sc2c([nH]1)ccc(c2)[N+](=O)[O-])CN1CCOCC1

STK614305
Synonyms: methyl[3-(2-hydroxypropyl)-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-7-yl]acetate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)OCN(C1)CC(O)C

STK614307
Synonyms: 2-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]acetamide
Smiles: O=C(Cc1nn2c(n1)nc(cc2C)C)NCc1onc(n1)c1ccccc1

STK614311
Synonyms: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-{2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoethyl}-1,3-thiazolidine-2,4-dione
Smiles: OCCC1CCCCN1C(=O)CN1C(=O)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

STK855470
Synonyms: 4-[4-(2-methoxyphenyl)-3-methyl-1H-pyrazol-5-yl]benzene-1,3-diol
Smiles: COc1ccccc1c1c(C)n[nH]c1c1ccc(cc1O)O

STK614314
Synonyms: 7-cyclohexyl-2-(2-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1c1nn2c(n1)c1c(nc2)n(c(c1C)C)C1CCCCC1

STK614316
Synonyms: N-[(2E)-5-[(2,3-dimethylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]furan-2-carboxamide
Smiles: Cc1cccc(c1C)OCc1n[nH]/c(=N\C(=O)c2ccco2)/s1

STK614318
Synonyms: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-6-(pyrrolidin-1-yl)pyrimidine
Smiles: Cc1nn(c(c1)C)c1nc(N2CCCC2)c(c(n1)C)Br

STK855471
Synonyms: N-[2-(1H-imidazol-1-ylmethyl)-1-(2-methylpropyl)-1H-benzimidazol-5-yl]acetamide
Smiles: CC(Cn1c(Cn2cncc2)nc2c1ccc(c2)NC(=O)C)C

STK614321
Synonyms: 3-(3,4-dimethoxyphenyl)-7-[2-(4-ethylpiperazin-1-yl)ethoxy]-2H-chromen-2-one
Smiles: CCN1CCN(CC1)CCOc1ccc2c(c1)oc(=O)c(c2)c1ccc(c(c1)OC)OC

STK614322
Synonyms: N-cycloheptyl-3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanamide
Smiles: O=C(NC1CCCCCC1)CCc1c(=O)oc2c(c1C)ccc(c2)O

STK614324
Synonyms: N-{3-[(4-fluorobenzyl)amino]-3-oxopropyl}-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: O=C(NCc1ccc(cc1)F)CCNC(=O)N1CC(=Nc2c1cccc2)O

STK614329
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetamide
Smiles: CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)Nc1ccc2c(c1)OCCO2

STK855473
Synonyms: 2-(3-ethoxy-2-hydroxyphenyl)quinazolin-4-ol
Smiles: CCOc1cccc(c1O)c1nc(O)c2c(n1)cccc2

STK614330
Synonyms: 7-benzyl-5,6-dimethyl-3-(2-methylpropyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: CC(Cn1cnc2c(c1=N)c(C)c(n2Cc1ccccc1)C)C

STK614331
Synonyms: (5Z)-3-{4-[2-(2-hydroxyethyl)piperidin-1-yl]-4-oxobutyl}-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: OCCC1CCCCN1C(=O)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK855474
Synonyms: 7-methoxy-4-methyl-3-[3-(morpholin-4-yl)-3-oxopropyl]-2H-chromen-2-one
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCOCC1

STK614334
Synonyms: N-[3-(1H-imidazol-1-yl)propyl]-5,6-dimethyl-7-(pyridin-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: Cc1c(C)n(c2c1c(NCCCn1cncc1)ncn2)c1ccncc1

STK614335
Synonyms: N-(3-methoxypropyl)-N'-[2-oxo-1-(propan-2-yl)-2,3-dihydro-1H-indol-3-yl]ethanediamide
Smiles: COCCCNC(=O)C(=O)NC1c2ccccc2N(C1=O)C(C)C

STK614337
Synonyms: 3-hydroxy-N-{3-oxo-3-[(4-phenylbutan-2-yl)amino]propyl}quinoxaline-1(2H)-carboxamide
Smiles: CC(NC(=O)CCNC(=O)N1CC(=Nc2c1cccc2)O)CCc1ccccc1

STK614341
Synonyms: 6-{[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]amino}hexanoicacid
Smiles: OC(=O)CCCCCNC(=O)N1CC(=Nc2c1cccc2)O

STK855476
Synonyms: (2Z)-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl3,4-dimethoxybenzoate
Smiles: COc1ccc(cc1OC)C(=O)Oc1cc(C)c2c(c1)O/C(=C\c1cccnc1)/C2=O

STK614343
Synonyms: 8,9-dimethyl-2,7-di(pyridin-3-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c2c(n(c1C)c1cccnc1)ncn1c2nc(n1)c1cccnc1

STK614349
Synonyms: 1-(3,4-dimethoxyphenyl)-2-[(2-methoxyethyl)sulfanyl]-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole5,5-dioxide
Smiles: COCCSC1=NC2C(N1c1ccc(c(c1)OC)OC)CS(=O)(=O)C2

STK614350
Synonyms: 7-hydroxy-6-(2-hydroxyethyl)-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidine-5-carboxylicacid
Smiles: OCCc1c(nc2n(c1O)nc(c2c1ccccc1)C)C(=O)O

STK614357
Synonyms: 2-[2-amino-5-(2-methoxyphenoxy)pyrimidin-4-yl]-5-(naphthalen-1-ylmethoxy)phenol
Smiles: COc1ccccc1Oc1cnc(nc1c1ccc(cc1O)OCc1cccc2c1cccc2)N

STK855478
Synonyms: 3-[(4-methoxyphenyl)amino]-1,2,4-triazin-5-ol
Smiles: COc1ccc(cc1)Nc1nncc(n1)O

STK614362
Synonyms: 3-benzyl-1,5-dimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxylicacid
Smiles: OC(=O)c1sc2c(c1C)c(=O)n(c(=O)n2C)Cc1ccccc1

STK614364
Synonyms: 1-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-3-(furan-2-ylmethyl)urea
Smiles: N#Cc1c(NC(=O)NCc2ccco2)sc2c1CC(C)(C)OC2

STK614365
Synonyms: (7Z)-3-(2,3-dihydro-1H-inden-5-yl)-7-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Smiles: O=C1Nc2c(/C/1=c\1/sc3=NCN(Cn3c1=O)c1ccc3c(c1)CCC3)cccc2

STK614370
Synonyms: 1-amino-4-[(furan-2-ylmethyl)amino]-2-[(2-hydroxyethyl)(methyl)amino]anthracene-9,10-dione
Smiles: OCCN(c1cc(NCc2ccco2)c2c(c1N)C(=O)c1c(C2=O)cccc1)C

STK855480
Synonyms: 3-(4-fluorophenyl)-2-methyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-7-ol
Smiles: Fc1ccc(cc1)c1c(C)nn2c1nc(cc2O)C(C)C

STK614373
Synonyms: 4-{[(2Z)-3-[2-(4-methoxyphenyl)ethyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-4-oxobutanoicacid
Smiles: COc1ccc(cc1)CCN1/C(=N/C(=O)CCC(=O)O)/SC2C1CS(=O)(=O)C2

STK614378
Synonyms: 2-(4-methoxyphenyl)-8,9-dimethyl-7-(6-methylpyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccc(cc1)c1nn2c(n1)c1c(nc2)n(c(c1C)C)c1cccc(n1)C

STK855482
Synonyms: 2-(3,4-dimethoxyphenyl)-5-{4-[(4-methoxyphenyl)carbonyl]piperazin-1-yl}-1,3-oxazole-4-carbonitrile
Smiles: COc1ccc(cc1)C(=O)N1CCN(CC1)c1oc(nc1C#N)c1ccc(c(c1)OC)OC

STK614379
Synonyms: 5-[benzyl(methyl)amino]-4-chloro-2-phenylpyridazin-3(2H)-one
Smiles: O=c1c(Cl)c(cnn1c1ccccc1)N(Cc1ccccc1)C

STK855483
Synonyms: 3-acetyl-2-methylnaphtho[1,2-b]furan-5-yl3-chlorobenzoate
Smiles: Clc1cccc(c1)C(=O)Oc1cc2c(C(=O)C)c(oc2c2c1cccc2)C

STK855484
Synonyms: (2Z)-4-methyl-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-ylmorpholine-4-carboxylate
Smiles: O=C(N1CCOCC1)Oc1cc2O/C(=C\c3ccncc3)/C(=O)c2c(c1)C

STK614382
Synonyms: N-[(2Z)-3-(2,5-dimethoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-methylbutanamide
Smiles: COc1ccc(c(c1)N1/C(=N/C(=O)CC(C)C)/SC2C1CS(=O)(=O)C2)OC

STK614383
Synonyms: 5-[(2,5-dimethylbenzyl)oxy]-2-[5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]phenol
Smiles: COc1ccccc1c1c(ncnc1C(F)(F)F)c1ccc(cc1O)OCc1cc(C)ccc1C

STK614385
Synonyms: 4-{(E)-[4-hydroxy-1-(4-methoxybenzyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}benzoicacid
Smiles: COc1ccc(cc1)CN1C(=O)N=C(/C(=C\c2ccc(cc2)C(=O)O)/C1=O)O

STK855485
Synonyms: (5Z)-1-butyl-5-[5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCCCN1C(=NC(=O)/C(=C\2/NNC(C2)c2ccc(c(c2)OC)OC)/C1=O)S

STK614387
Synonyms: 3-(4-chlorophenyl)-7-[2-(4-ethylpiperazin-1-yl)ethoxy]-4H-chromen-4-one
Smiles: CCN1CCN(CC1)CCOc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK614391
Synonyms: 2-benzyl-8,9-dimethyl-7-(pyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1c(C)c2c(n1c1ccccn1)ncn1c2nc(n1)Cc1ccccc1

STK614393
Synonyms: 4-chloro-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(propan-2-yl)pyridazin-3(2H)-one
Smiles: Cc1cccc(c1C)N1CCN(CC1)c1cnn(c(=O)c1Cl)C(C)C

STK614395
Synonyms: butyl2-(4-hydroxy-6-methyl-2-sulfanylpyrimidin-5-yl)propanoate
Smiles: CCCCOC(=O)C(c1c(C)nc(nc1O)S)C

STK614396
Synonyms: N-(2-{[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]amino}-2-oxoethyl)biphenyl-4-carboxamide
Smiles: O=C(NCc1cc(=O)n(c(=O)n1C)C)CNC(=O)c1ccc(cc1)c1ccccc1

STK614399
Synonyms: 7-{4-[N-(tert-butoxycarbonyl)glycyl]piperazin-1-yl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=O)CNC(=O)OC(C)(C)C)c(c2)F

STK614400
Synonyms: 5-[(2,1,3-benzoxadiazol-4-ylamino)methylidene]-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=S)N(C)C(=O)C(=CNc2cccc3c2non3)C1=O

STK614401
Synonyms: 6-benzyl-7-(4-phenylpiperazin-1-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Smiles: O=c1c(Cc2ccccc2)c(nc2n1CCS2)N1CCN(CC1)c1ccccc1

STK614402
Synonyms: 7-{2-[4-(2-methoxyphenyl)piperazin-1-yl]ethoxy}-3-phenyl-4H-chromen-4-one
Smiles: COc1ccccc1N1CCN(CC1)CCOc1ccc2c(c1)occ(c2=O)c1ccccc1

STK855489
Synonyms: 2-[4-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-5-[2-(2,6-dimethylmorpholin-4-yl)ethoxy]phenol
Smiles: COc1cc(ccc1OC)c1c[nH]nc1c1ccc(cc1O)OCCN1CC(C)OC(C1)C

STK614408
Synonyms: 1-[(2E)-5-butyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3,4-dichlorophenyl)urea
Smiles: CCCCc1n[nH]/c(=N\C(=O)Nc2ccc(c(c2)Cl)Cl)/s1

STK614411
Synonyms: (7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)(4-methylpiperidin-1-yl)methanone
Smiles: CC1CCN(CC1)C(=O)c1nn2c(n1)nc(cc2O)C

STK614415
Synonyms: 1-(2-chlorobenzyl)-4-(4-methylpiperazin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine
Smiles: CN1CCN(CC1)c1ncnc2c1cnn2Cc1ccccc1Cl

STK614417
Synonyms: 2-phenoxy-1-(2-phenyl-6,7-dihydro[1,3]thiazolo[5,4-c]pyridin-5(4H)-yl)ethanone
Smiles: O=C(N1CCc2c(C1)sc(n2)c1ccccc1)COc1ccccc1

STK614421
Synonyms: 1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxylicacid
Smiles: Cc1cccc(c1)n1ccc(=O)c(n1)C(=O)O

STK614424
Synonyms: 2-[(4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
Smiles: CCc1cc(=O)oc2c1ccc(c2C)OCC(=O)NC1CC(C)(C)NC(C1)(C)C

STK614426
Synonyms: N-[2-(1H-imidazol-1-ylmethyl)-1-(2-methylpropyl)-1H-benzimidazol-5-yl]-2-methylpropanamide
Smiles: CC(Cn1c(Cn2cncc2)nc2c1ccc(c2)NC(=O)C(C)C)C

STK614427
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-2-[(5Z)-5-(2-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: CCN(C1CCS(=O)(=O)C1)C(=O)CN1C(=O)S/C(=C\c2ccccc2OC)/C1=O

STK855492
Synonyms: 5-chloro-2-[(2-fluorobenzyl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide
Smiles: Clc1cnc(nc1C(=O)Nc1ccccc1C(F)(F)F)SCc1ccccc1F

STK614430
Synonyms: 2-(4-fluorophenyl)-5-(4-phenoxyphenyl)-4-phenyl-1H-imidazole
Smiles: Fc1ccc(cc1)c1nc(c([nH]1)c1ccc(cc1)Oc1ccccc1)c1ccccc1

STK614431
Synonyms: N-[(Z)-(1-ethyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]tyrosine
Smiles: CCN1C(=O)N=C(/C(=C/NC(C(=O)O)Cc2ccc(cc2)O)/C1=O)O

STK614433
Synonyms: 2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-N-(1,3-thiazol-2-yl)acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1nccs1

STK614434
Synonyms: 3-(2,4-dichlorophenyl)-6-(1H-pyrazol-1-yl)[1,2,4]triazolo[4,3-b]pyridazine
Smiles: Clc1ccc(c(c1)Cl)c1nnc2n1nc(cc2)n1cccn1

STK614435
Synonyms: 2-(4-ethoxyphenyl)-N-{2-[2-(4-methoxyphenyl)-1H-imidazol-5-yl]ethyl}acetamide
Smiles: CCOc1ccc(cc1)CC(=O)NCCc1cnc([nH]1)c1ccc(cc1)OC

STK614436
Synonyms: N-{[5-(2,5-dichlorophenyl)furan-2-yl]methyl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)butanamide
Smiles: CCCC(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(o1)c1cc(Cl)ccc1Cl

STK614437
Synonyms: (2E)-3-(3-methoxyphenyl)-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]prop-2-enamide
Smiles: COc1cccc(c1)/C=C/C(=O)NCCc1nnc2n1cccc2

STK855494
Synonyms: 2-[(4-chlorophenoxy)methyl]-5-{[2-(4-methoxyphenyl)ethyl]amino}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NCCc1ccc(cc1)OC)COc1ccc(cc1)Cl

STK855495
Synonyms: (5E)-2,6-dihydroxy-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}pyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C/c2ccc(o2)c2ccc(cc2)[N+](=O)[O-])/C(=N1)O

STK614441
Synonyms: 5-[(2,5-dimethylbenzyl)oxy]-2-[4-(2-ethoxyphenoxy)-1H-pyrazol-5-yl]phenol
Smiles: CCOc1ccccc1Oc1cn[nH]c1c1ccc(cc1O)OCc1cc(C)ccc1C