FULL DB

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

STK848193
Synonyms: 8-(2,5-dimethoxyphenyl)-3-(furan-2-ylmethyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1cc(OC)ccc1OC)Cc1ccco1

STK574233
Synonyms: 5-[(2-fluorobenzyl)oxy]-2-[4-phenyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]phenol
Smiles: Oc1cc(ccc1c1onc(c1c1ccccc1)C(F)(F)F)OCc1ccccc1F

STK848194
Synonyms: N-[(2E)-6-(dimethylsulfamoyl)-1,3-benzothiazol-2(3H)-ylidene]quinoline-2-carboxamide
Smiles: O=C(c1ccc2c(n1)cccc2)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)N(C)C

STK574234
Synonyms: (5Z)-5-[1-(cyclopropylamino)ethylidene]-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C(/NC2CC2)\C)/C(=O)N1c1ccccc1C

STK574237
Synonyms: 11-chloro-3-[2-methyl-6-(propan-2-yl)phenyl]-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one
Smiles: CC(c1cccc(c1N1COc2c(C1)c1oc(=O)c3c(c1cc2Cl)CCC3)C)C

STK574242
Synonyms: 2-[(2,3-dimethylphenyl)amino]-4-(3-methoxyphenyl)-8-methyl-4H-pyrimido[1,2-a][1,3,5]triazin-6-ol
Smiles: COc1cccc(c1)C1N=C(Nc2cccc(c2C)C)N=c2n1c(O)cc(n2)C

STK574246
Synonyms: (3E)-3-[2-(naphthalen-1-yl)-2-oxoethylidene]-1,3-dihydro-2H-indol-2-one
Smiles: O=C1Nc2c(/C/1=C\C(=O)c1cccc3c1cccc3)cccc2

STK848196
Synonyms: ethyl{[3-(4-methoxyphenyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)OC)C(F)(F)F

STK848198
Synonyms: 6-benzyl-3-(4-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)c(c2O)Cc1ccccc1

STK574257
Synonyms: 6-amino-1-(4-fluorophenyl)-3-methyl-4-(thiophen-2-yl)-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cccs1)c(C)nn2c1ccc(cc1)F

STK574258
Synonyms: 3-tert-butyl-7-(3,4-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Cc1ccc(cc1C)n1ncc2c1ncn1c2nnc1C(C)(C)C

STK574263
Synonyms: 2-[2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-[(4-fluorobenzyl)oxy]phenol
Smiles: COc1ccccc1c1c(nc(nc1C(F)(F)F)N)c1ccc(cc1O)OCc1ccc(cc1)F

STK574264
Synonyms: 4-{(2E)-2-[(2-chloro-7-methoxyquinolin-3-yl)methylidene]hydrazinyl}benzoicacid
Smiles: COc1ccc2c(c1)nc(c(c2)/C=N/Nc1ccc(cc1)C(=O)O)Cl

STK574267
Synonyms: (5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-4-methyl-2,6-dioxo-5-[4-(prop-2-en-1-yloxy)benzylidene]-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: C=CCOc1ccc(cc1)/C=C/1\C(=O)N(C2CCS(=O)(=O)C2)C(=O)C(=C1C)C#N

STK574268
Synonyms: (5Z)-5-({3-[2-methyl-4-(2-methylpropoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-(2-methylpropyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CC(COc1ccc(c(c1)C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC(C)C)c1ccccc1)C

STK574269
Synonyms: 2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(3-hydroxypropyl)acetamide
Smiles: OCCCNC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl

STK574278
Synonyms: 2-({5-[(1S)-1-amino-3-(methylsulfanyl)propyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(4-bromophenyl)acetamide
Smiles: CSCC[C@@H](c1nnc(o1)SCC(=O)Nc1ccc(cc1)Br)N

STK574281
Synonyms: (4E)-2-(2-methoxyphenyl)-4-[(pyrimidin-2-ylamino)methylidene]isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccccc1N1C(=O)/C(=C/Nc2ncccn2)/c2c(C1=O)cccc2

STK574282
Synonyms: 1-[2-benzyl-10-(4-methoxyphenyl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: COc1ccc(cc1)C1C(=C(C)Oc2c1c1nc(nn1cn2)Cc1ccccc1)C(=O)C

STK848201
Synonyms: 2-[2-amino-5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-5-[(2-methylbenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cnc(nc1c1ccc(cc1O)OCc1ccccc1C)N

STK574284
Synonyms: 6,8-dimethyl-4-[(4-phenylpiperazin-1-yl)methyl]-2H-chromen-2-one
Smiles: Cc1cc(C)c2c(c1)c(CN1CCN(CC1)c1ccccc1)cc(=O)o2

STK574287
Synonyms: 2-{(2E)-4-hydroxy-2-[(2E)-(2-oxo-1,3-thiazolidin-4-ylidene)hydrazinylidene]-2,5-dihydro-1,3-thiazol-5-yl}-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CC1S/C(=N/N=C/2\CSC(=O)N2)/N=C1O

STK574288
Synonyms: 2-(2-phenyl-4-thioxo-5,6,7,8-tetrahydroquinazolin-1(4H)-yl)ethylacetate
Smiles: CC(=O)OCCn1c(nc(=S)c2c1CCCC2)c1ccccc1

STK574292
Synonyms: [(5S)-5-(benzylcarbamoyl)-3-(2,3-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]aceticacid
Smiles: COc1c(OC)cccc1C1=NO[C@@](C1)(CC(=O)O)C(=O)NCc1ccccc1

STK574297
Synonyms: 4-{[(2Z)-3-(4-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1)Cl)CS(=O)(=O)C2

STK574299
Synonyms: 2,11-di(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1nn(c2c1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1ccco1)c1ccccc1

STK574302
Synonyms: 1-(3-hydroxyphenyl)-2-(pyridin-4-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Oc1cccc(c1)C1N(Cc2ccncc2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK574304
Synonyms: 7-[2-hydroxy-3-(4-methylphenoxy)propyl]-1,3-dimethyl-8-(methylamino)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(=O)n(c(=O)n2C)C

STK574307
Synonyms: N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(2-hydroxy-3,4-dimethylphenyl)-1H-pyrazole-3-carboxamide
Smiles: CCSc1nnc(s1)NC(=O)c1n[nH]c(c1)c1ccc(c(c1O)C)C

STK848208
Synonyms: 2-{[3-(4-methoxyphenyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl]oxy}acetamide
Smiles: COc1ccc(cc1)c1c(=O)c2ccc(cc2oc1C(F)(F)F)OCC(=O)N

STK574313
Synonyms: ethyl(4-hydroxy-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazolo[3,4-b]pyridin-6-yl)acetate
Smiles: CCOC(=O)Cc1cc(O)c2c(n1)[nH]n(c2=O)c1ccccc1

STK574314
Synonyms: 2-{(5E)-5-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}ethanesulfonicacid
Smiles: CC1Oc2c(C1)cc(cc2)/C=C\1/SC(=S)N(C1=O)CCS(=O)(=O)O

STK574316
Synonyms: furan-2-yl{4-[4-hydroxy-6-(methoxymethyl)pyrimidin-2-yl]piperazin-1-yl}methanone
Smiles: COCc1cc(O)nc(n1)N1CCN(CC1)C(=O)c1ccco1

STK574317
Synonyms: (5Z)-3-(2-fluorobenzyl)-2-hydroxy-5-{[5-(phenylsulfanyl)furan-2-yl]methylidene}-3,5-dihydro-4H-imidazol-4-one
Smiles: OC1=N/C(=C\c2ccc(o2)Sc2ccccc2)/C(=O)N1Cc1ccccc1F

STK574323
Synonyms: N-[2-(2-phenylethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]methanesulfonamide
Smiles: CS(=O)(=O)Nc1ccc2c(c1)nc1n2CCN(C1)CCc1ccccc1

STK574325
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(3-ethoxyphenyl)-5-(2-hydroxyethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)OCC)c([nH]n2)c1cc(Cl)c(cc1O)C

STK574326
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(3-ethoxyphenyl)-5-(3-hydroxypropyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCCN1C(=O)c2c(C1c1cccc(c1)OCC)c([nH]n2)c1cc(Cl)c(cc1O)C

STK848210
Synonyms: 2-methoxyethyl1,2-dimethyl-5-[(methylsulfonyl)oxy]-1H-indole-3-carboxylate
Smiles: COCCOC(=O)c1c(C)n(c2c1cc(cc2)OS(=O)(=O)C)C

STK574333
Synonyms: 2-[4-(3-methoxyphenoxy)-3-methyl-1H-pyrazol-5-yl]-5-[(4-methylbenzyl)oxy]phenol
Smiles: COc1cccc(c1)Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1ccc(cc1)C

STK574334
Synonyms: 6-ethyl-4-{[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl}-2-oxo-2H-chromen-7-olate
Smiles: CCc1cc2c(cc1[O-])oc(=O)cc2C[NH+]1CCN(CC1)c1ccc(cc1)OC

STK848211
Synonyms: N-[3-(methylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-oxo-4H-chromene-2-carboxamide
Smiles: CNC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)cccc3)sc2c1CCCC2

STK574343
Synonyms: [(5-{(1S)-1-[(tert-butoxycarbonyl)amino]-2-phenylethyl}-1,3,4-oxadiazol-2-yl)sulfanyl]aceticacid
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)SCC(=O)O)Cc1ccccc1

STK574348
Synonyms: ethyl(2Z)-2-[(7,7-dimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinazolin-2-yl)imino]-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1s/c(=N\C2=NC(C3=C(N2)CC(C)(C)CC3=O)c2ccccc2)/[nH]c1C

STK574349
Synonyms: 7-hydroxy-2-(prop-2-yn-1-ylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-5,6-dihydropyrido[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1cc(cc(c1OC)OC)C1CC(=Nc2c1c(=O)[nH]c(n2)SCC#C)O

STK574354
Synonyms: N-[(4-methylphenyl)carbamoyl]-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)Nc1ccc(cc1)C

STK574357
Synonyms: (1S,2S)-N'-[(E)-(2-hydroxy-6-methylquinolin-3-yl)methylidene]-2-phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cc2cc(C)ccc2nc1O

STK848213
Synonyms: N-phenyl-4-[2-(pyridin-2-yl)-1H-indol-3-yl]butanamide
Smiles: O=C(Nc1ccccc1)CCCc1c([nH]c2c1cccc2)c1ccccn1

STK574362
Synonyms: (3Z)-1-(4-acetylphenyl)-3-(pyridin-3-ylmethylidene)pyrrolidine-2,5-dione
Smiles: CC(=O)c1ccc(cc1)N1C(=O)C/C(=C/c2cccnc2)/C1=O

STK574364
Synonyms: 9-propyl-2-(thiophen-2-yl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CCCN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1cccs1

STK848214
Synonyms: 6-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-4H-chromene-2-carboxamide
Smiles: Clc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C

STK574367
Synonyms: 5-{4-[(2-chlorobenzyl)oxy]phenyl}-N'-[(E)-pyridin-3-ylmethylidene]-1H-pyrazole-3-carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc(cc1)OCc1ccccc1Cl)N/N=C/c1cccnc1

STK574372
Synonyms: [1-methyl-9-(4-methylphenyl)-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]aceticacid
Smiles: OC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)C

STK848217
Synonyms: (5Z)-5-(1H-benzimidazol-2-ylmethylidene)-3-(2-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Cc1ccccc1N1C(=S)S/C(=C\c2nc3c([nH]2)cccc3)/C1=O

STK574381
Synonyms: N-{3-[(furan-2-ylmethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-5-(2-hydroxyphenyl)-1H-pyrazole-3-carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccccc1O)Nc1sc2c(c1C(=O)NCc1ccco1)CCCC2

STK574383
Synonyms: 3,4-diethoxy-N-[2-(1H-imidazol-5-yl)ethyl]benzamide
Smiles: CCOc1cc(ccc1OCC)C(=O)NCCc1cnc[nH]1

STK574384
Synonyms: 2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol
Smiles: Cc1nnc(s1)SCc1cc(O)n2c(n1)nc1c2cccc1

STK574385
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-5-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-3-carboxamide
Smiles: Clc1ccc(c(c1)c1[nH]nc(c1)C(=O)NCc1ccc2c(c1)OCO2)O

STK574387
Synonyms: 2-chloro-5-[(2E)-2-(5-cyano-6-hydroxy-4-methyl-2-oxopyridin-3(2H)-ylidene)hydrazinyl]benzoicacid
Smiles: N#CC1=C(C)/C(=N\Nc2ccc(c(c2)C(=O)O)Cl)/C(=O)N=C1O

STK574391
Synonyms: 8-(4-benzylpiperidin-1-yl)-2-methyl-3-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidine
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2N2CCC(CC2)Cc2ccccc2)CCC1

STK574394
Synonyms: (6Z)-6-[(4-methylphenyl)imino]-4-(trifluoromethyl)-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: Cc1ccc(cc1)/N=c/1\nc(nc([nH]1)N)C(F)(F)F

STK574398
Synonyms: 2-(4-fluorophenyl)-N-[(2E)-3-(4-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: COc1ccc(cc1)CN1/C(=N\C(=O)Cc2ccc(cc2)F)/SC2C1CS(=O)(=O)C2

STK574399
Synonyms: N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)Nc1cccc(c1)C(F)(F)F

STK574400
Synonyms: 5-bromo-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-1H-indole-2-carboxamide
Smiles: CN1CCC(CC1)N(C(=O)c1[nH]c2c(c1C)cc(cc2)Br)C

STK574401
Synonyms: N-[(2Z)-5-(pyridin-3-yl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: CC(=O)/N=c\1/[nH]nc(s1)c1cccnc1

STK848224
Synonyms: [4-(8,10-dimethyl-2-propylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-4-yl)piperazin-1-yl]acetonitrile
Smiles: CCCc1cc(N2CCN(CC2)CC#N)n2c(n1)c1c(C)cc(nc1n2)C

STK574405
Synonyms: N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-5-fluoro-3-methyl-1-benzofuran-2-carboxamide
Smiles: CN(C(c1ccco1)CNC(=O)c1oc2c(c1C)cc(cc2)F)C

STK574414
Synonyms: 5-hydroxy-2-({2-[(5E)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)benzoicacid
Smiles: O=C(C(N1C(=S)S/C(=C/c2cccs2)/C1=O)C)Nc1ccc(cc1C(=O)O)O

STK574421
Synonyms: 7-(furan-2-yl)-5-hydroxy-2-methyl-N-(pyridin-2-yl)-4-(pyridin-3-yl)-4,6,7,8-tetrahydroquinoline-3-carboxamide
Smiles: CC1=C(C(=O)Nc2ccccn2)C(C2=C(CC(CC2=N1)c1ccco1)O)c1cccnc1

STK574423
Synonyms: (5Z)-6-hydroxy-5-[(2E)-1-hydroxy-3-(pyridin-4-yl)prop-2-en-1-ylidene]-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\C=C\c2ccncc2)/O)/C1=O)O

STK574425
Synonyms: 2-[4-(4-methoxyphenoxy)-1H-pyrazol-3-yl]-5-[(4-methylbenzyl)oxy]phenol
Smiles: COc1ccc(cc1)Oc1c[nH]nc1c1ccc(cc1O)OCc1ccc(cc1)C

STK574429
Synonyms: 2-(4-methoxyphenyl)pyrimido[1,2-a]benzimidazol-4-ol
Smiles: COc1ccc(cc1)c1cc(O)n2c(n1)nc1c2cccc1

STK574432
Synonyms: 4-(4-chlorophenyl)-1-(2-methoxyphenyl)-3-(thiophen-3-yl)piperazine-2,5-dione
Smiles: COc1ccccc1N1CC(=O)N(C(C1=O)c1cscc1)c1ccc(cc1)Cl

STK574433
Synonyms: [(benzylamino)(4-chlorophenyl)methyl](2-phenylethyl)phosphinicacid
Smiles: Clc1ccc(cc1)C(P(=O)(CCc1ccccc1)O)NCc1ccccc1

STK574438
Synonyms: N-(3-bromobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-propoxybenzamide
Smiles: CCCOc1cccc(c1)C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Br

STK574439
Synonyms: N-(cyclooctylcarbamoyl)-D-alanine
Smiles: C[C@H](C(=O)O)NC(=O)NC1CCCCCCC1

STK574442
Synonyms: 2-[(6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-4-ylmethyl)propanamide
Smiles: CCc1cc(=O)oc2c1cc(Cl)c(c2)OC(C(=O)NCc1ccncc1)C

STK574444
Synonyms: 6-acetyl-2-thioxo-4-(trifluoromethyl)-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile
Smiles: N#Cc1c(=S)[nH]c2c(c1C(F)(F)F)CN(CC2)C(=O)C

STK574446
Synonyms: 8-[(4-benzylpiperazin-1-yl)methyl]-1,3-dimethyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2CCCc1ccccc1)CN1CCN(CC1)Cc1ccccc1

STK574448
Synonyms: 8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1[nH]c2c(n1)n(C)c(=O)nc2O

STK574451
Synonyms: 3-(5,9-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)propanoicacid
Smiles: CC1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)CCC(=O)O

STK848231
Synonyms: methyl4-[(4-fluorophenyl)carbamoyl]-6-hydroxy-2-methyl-4,5-dihydropyridine-3-carboxylate
Smiles: COC(=O)C1=C(C)N=C(CC1C(=O)Nc1ccc(cc1)F)O

STK574457
Synonyms: 2,4-dihydroxy-5-(3-methoxyphenyl)-1-(3-methoxypropyl)-1,5-dihydro-6H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-6-one
Smiles: COCCCn1c(O)nc(c2c1=NC1=C(C2c2cccc(c2)OC)C(=O)c2c1cccc2)O

STK574459
Synonyms: 4-[(2E)-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}hydrazinyl]-5-phenylthieno[2,3-d]pyrimidine
Smiles: [O-][N+](=O)c1ccccc1c1ccc(o1)/C=N/Nc1ncnc2c1c(cs2)c1ccccc1

STK574466
Synonyms: 3-(2-{(E)-[2-hydroxy-1-(4-methylbenzyl)-5-oxo-1,5-dihydro-4H-imidazol-4-ylidene]methyl}-1H-pyrrol-1-yl)benzoicacid
Smiles: Cc1ccc(cc1)CN1C(=N/C(=C/c2cccn2c2cccc(c2)C(=O)O)/C1=O)O

STK574469
Synonyms: 4-amino-N-(2-chlorobenzyl)-3-(4-methoxyphenyl)-2-thioxo-2,3-dihydro-1,3-thiazole-5-carboxamide
Smiles: COc1ccc(cc1)n1c(=S)sc(c1N)C(=O)NCc1ccccc1Cl

STK574475
Synonyms: N-(3-methoxypropyl)-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: COCCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2

STK574477
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-propyl-1H-1,2,3-triazole-4-carboxylicacid
Smiles: CCCc1c(nnn1c1nonc1N)C(=O)O

STK574482
Synonyms: 2-{[4-amino-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-bromopyridin-2-yl)acetamide
Smiles: O=C(Nc1ccc(cn1)Br)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK848232
Synonyms: 4-hydroxy-2-phenyl-6-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: CCCc1cc(O)c2c(n1)[nH]n(c2=O)c1ccccc1

STK848235
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethylbenzyl)-4-oxo-4H-chromene-2-carboxamide
Smiles: CCc1ccc(cc1)CN(C(=O)c1cc(=O)c2c(o1)cccc2)C1CCS(=O)(=O)C1

STK574489
Synonyms: 3-[(2S)-1-oxo-1-(pyrrolidin-1-yl)propan-2-yl]-1,2,3-benzotriazin-4(3H)-one
Smiles: O=C([C@@H](n1nnc2c(c1=O)cccc2)C)N1CCCC1

STK848236
Synonyms: 2,5-dimethyl-3-(4-methylphenyl)-N-[3-(morpholin-4-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Cc1ccc(cc1)c1c(C)nn2c1nc(C)cc2NCCCN1CCOCC1

STK574493
Synonyms: 6-chloro-2-[(2-chloro-6-fluorobenzyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Fc1cccc(c1CNc1nc2n(n1)c(O)c(c(n2)C)Cl)Cl

STK574494
Synonyms: N-(5-hydroxy-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1cc(O)nc2n1nc(n2)c1ccccc1

STK574495
Synonyms: 2-[4-(4-chlorophenyl)-3-methyl-1,2-oxazol-5-yl]-5-[(4-fluorobenzyl)oxy]phenol
Smiles: Fc1ccc(cc1)COc1ccc(c(c1)O)c1onc(c1c1ccc(cc1)Cl)C

STK574496
Synonyms: 4-[4-(2,4-dimethylbenzyl)piperazin-1-yl]-2,8,10-trimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine
Smiles: Cc1ccc(c(c1)C)CN1CCN(CC1)c1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK848237
Synonyms: N-cyclopentyl-2-methyl-3-phenyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-amine
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2NC2CCCC2)CCCC1

STK574500
Synonyms: 3-phenoxy-N-[(1-phenylcyclopentyl)methyl]propanamide
Smiles: O=C(NCC1(CCCC1)c1ccccc1)CCOc1ccccc1

STK574504
Synonyms: N-(5-chloro-2-cyanophenyl)-2-(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Smiles: N#Cc1ccc(cc1NC(=O)CN1CCc2c(C1C)cc1c(c2)OCCCO1)Cl

STK574506
Synonyms: N-cyclohexyl-5,6-dimethylfuro[2,3-d]pyrimidin-4-amine
Smiles: Cc1c(C)oc2c1c(NC1CCCCC1)ncn2

STK574509
Synonyms: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-2-oxo-7-phenyl-2H-chromen-6-olate
Smiles: O=c1oc2cc(c3ccccc3)c(cc2c(c1)C[NH+]1CCN(CC1)Cc1ccccc1)[O-]

STK574511
Synonyms: 4-[({3-cyclohexyl-3-[4-(propan-2-yloxy)phenyl]propyl}amino)methyl]-N,N-dimethylaniline
Smiles: CC(Oc1ccc(cc1)C(C1CCCCC1)CCNCc1ccc(cc1)N(C)C)C

STK848240
Synonyms: 3-(3,4-dimethoxyphenyl)-2,5-dimethyl-N-(2-phenylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COc1cc(ccc1OC)c1c(C)nn2c1nc(C)cc2NCCc1ccccc1

STK574517
Synonyms: 4-butyl-N-[2-(furan-2-yl)-2-(morpholin-4-yl)ethyl]cyclohexanecarboxamide
Smiles: CCCCC1CCC(CC1)C(=O)NCC(c1ccco1)N1CCOCC1

STK848241
Synonyms: 1-(2-fluorophenyl)-2-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: O=C1N(C)C(c2c1oc1ccccc1c2=O)c1ccccc1F

STK848242
Synonyms: 2-[(4-fluorobenzyl)amino]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: CCCc1cc(O)n2c(n1)nc(n2)NCc1ccc(cc1)F

STK574521
Synonyms: 1-(4-chlorophenyl)-N-(3-methylphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)C)c1ccc(cc1)Cl

STK574524
Synonyms: 1-(3-ethoxy-4-hydroxyphenyl)-2-(4-methoxybenzyl)-5,7-dimethyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cc(ccc1O)C1N(Cc2ccc(cc2)OC)C(=O)c2c1c(=O)c1c(o2)c(C)cc(c1)C

STK574525
Synonyms: 7-(4-ethylpiperazin-1-yl)-5-methyl-3-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine
Smiles: CCN1CCN(CC1)c1cc(C)nc2n1ncc2c1ccc(cc1)C

STK574529
Synonyms: 2-[(3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]-N-(pyridin-2-ylmethyl)acetamide
Smiles: O=C(COc1cc(C)cc2c1c(C)c(c(=O)o2)Cc1ccccc1)NCc1ccccn1

STK574530
Synonyms: 2-cyclohexyl-3-(2-methoxyethyl)-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)C1CCCCC1

STK848244
Synonyms: 2,5-dimethyl-3-(4-methylphenyl)-N-(2-phenylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Cc1ccc(cc1)c1c(C)nn2c1nc(C)cc2NCCc1ccccc1

STK848245
Synonyms: 2-{[3-cyano-6-hydroxy-4-(4-methylphenyl)-4,5-dihydropyridin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)N=C(CC1c1ccc(cc1)C)O

STK574534
Synonyms: propyl4-[(5-{4-[(2,5-dimethylbenzyl)oxy]-2-hydroxyphenyl}-1H-pyrazol-4-yl)oxy]benzoate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1cn[nH]c1c1ccc(cc1O)OCc1cc(C)ccc1C

STK574536
Synonyms: 4-(2,4-dihydroxy-1-methyl-6-oxo-5,6-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-5-yl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)C1C2=C(N=c3c1c(O)nc(n3C)O)c1c(C2=O)cccc1

STK574537
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-5-hydroxy-7,7-dimethyl-2-oxo-2,3,4,6,7,8-hexahydroquinoline-4-carboxamide
Smiles: O=C1N=C2CC(C)(C)CC(=C2C(C1)C(=O)Nc1cc(ccc1Cl)C(F)(F)F)O

STK574539
Synonyms: N-[(2Z)-6-methyl-1,3-benzothiazol-2(3H)-ylidene]-4-oxo-4H-chromene-2-carboxamide
Smiles: Cc1ccc2c(c1)s/c(=N\C(=O)c1cc(=O)c3c(o1)cccc3)/[nH]2

STK848246
Synonyms: 8-(4-methoxyphenyl)-6-oxo-3-phenyl-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)OC)c1ccccc1

STK574543
Synonyms: N-tert-butyl-2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)NC(C)(C)C)N=C2C(=C(O)CCC2)C1c1ccco1

STK574545
Synonyms: N-(3-bromobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-propoxybenzamide
Smiles: CCCOc1ccccc1C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Br

STK574546
Synonyms: 7-chloro-3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidine
Smiles: CC(c1cc(Cl)n2c(n1)c(cn2)c1ccccc1)C

STK574548
Synonyms: N-({4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]phenyl}carbonyl)-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK574550
Synonyms: 2-{[4-amino-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-bromo-2-fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1F)Br)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK574553
Synonyms: (5E)-5-({[3-(dimethylamino)propyl]amino}methylidene)-6-hydroxy-3-(3-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: CN(CCCN/C=C/1\C(=NC(=O)N(C1=O)c1cccc(c1)C)O)C

STK574555
Synonyms: (4E)-2-(3,4-dimethylphenyl)-4-[(pyridin-2-ylamino)methylidene]isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1N(c2ccc(c(c2)C)C)C(=O)c2c(/C/1=C\Nc1ccccn1)cccc2

STK574557
Synonyms: 1-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-N-(3,5-dimethoxyphenyl)-5-oxo-L-prolinamide
Smiles: COc1cc(cc(c1)OC)NC(=O)[C@@H]1CCC(=O)N1C1OC(=O)c2c1ccc(c2OC)OC

STK574561
Synonyms: (4E)-2-(2,5-dimethoxyphenyl)-4-{[(pyridin-2-ylmethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccc(c(c1)N1C(=O)/C(=C/NCc2ccccn2)/c2c(C1=O)cccc2)OC

STK574562
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(3,4-diethoxyphenyl)-5-(pyridin-3-ylmethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: CCOc1cc(ccc1OCC)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(Cl)c(cc1O)C

STK574566
Synonyms: N,N-diethyl-2-(7-ethyl-2-methyl-4H-[1,3]thiazolo[5,4-b]indol-4-yl)ethanamine
Smiles: CCN(CCn1c2ccc(cc2c2c1sc(n2)C)CC)CC

STK574570
Synonyms: 2-hydroxy-4-({(E)-[2-(6-methylpyridin-2-yl)-1,3-dioxo-2,3-dihydroisoquinolin-4(1H)-ylidene]methyl}amino)benzoicacid
Smiles: Cc1cccc(n1)N1C(=O)/C(=C/Nc2ccc(c(c2)O)C(=O)O)/c2c(C1=O)cccc2

STK574573
Synonyms: tert-butyl(3S)-3-({(2R)-1-[(2,4-dimethylphenyl)amino]-1-oxopropan-2-yl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: Cc1ccc(c(c1)C)NC(=O)[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

STK848251
Synonyms: N-(2-bromophenyl)-2-(4-hydroxy-2-imino-2,5-dihydro-1,3-thiazol-5-yl)acetamide
Smiles: O=C(Nc1ccccc1Br)CC1SC(=N)N=C1O

STK574578
Synonyms: 7-bromo-2-(3-hydroxypropyl)-1-(4-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: OCCCN1C(=O)c2c(C1c1ccc(cc1)OC)c(=O)c1c(o2)ccc(c1)Br

STK574579
Synonyms: N-[2-(dimethylamino)ethyl]-5-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CN(CCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCCC2)C

STK574582
Synonyms: (4E)-2-(3,4-dimethylphenyl)-4-{[(1,1-dioxidotetrahydrothiophen-3-yl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1N(c2ccc(c(c2)C)C)C(=O)c2c(/C/1=C\NC1CCS(=O)(=O)C1)cccc2

STK848255
Synonyms: methyl{[3-(biphenyl-4-yloxy)-4-oxo-4H-chromen-7-yl]oxy}acetate
Smiles: COC(=O)COc1ccc2c(c1)occ(c2=O)Oc1ccc(cc1)c1ccccc1

STK574594
Synonyms: methylN-{[2-(trifluoromethyl)phenyl]carbamoyl}-D-leucinate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccccc1C(F)(F)F)CC(C)C

STK574598
Synonyms: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-ethyl-2,6-dihydroxypyrimidin-4(3H)-one
Smiles: COc1cc2c(cc1OC)CCNC2c1c(O)nc(n(c1=O)CC)O

STK574599
Synonyms: 2,8,10-trimethyl-4-{4-[2-(naphthalen-1-yloxy)ethyl]piperazin-1-yl}pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine
Smiles: Cc1cc(N2CCN(CC2)CCOc2cccc3c2cccc3)n2c(n1)c1c(C)cc(nc1n2)C

STK574600
Synonyms: N-[3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-6-methylheptyl]-4-methylcyclohexanamine
Smiles: CC(CCC(C1CCOC(C1)(C)C)CCNC1CCC(CC1)C)C

STK574602
Synonyms: 4-(3,4,5-trimethoxyphenyl)-4,10-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: COc1cc(cc(c1OC)OC)C1N=C(N)N=c2n1c1ccccc1[nH]2

STK574603
Synonyms: (2E)-3-(5,9-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)prop-2-enoicacid
Smiles: CC1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)/C=C/C(=O)O

STK574605
Synonyms: ethyl10-(3,4-dimethoxyphenyl)-8-methyl-2-(pyridin-4-yl)-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-9-carboxylate
Smiles: CCOC(=O)C1=C(C)Oc2c(C1c1ccc(c(c1)OC)OC)c1nc(nn1cn2)c1ccncc1

STK574610
Synonyms: [(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-1-yl]aceticacid
Smiles: OC(=O)CN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccccc1F

STK574616
Synonyms: N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-2-(3-hydroxy-5-methyl-4H-pyrazol-4-yl)acetohydrazide
Smiles: COc1ccc(c(c1)/C=N/NC(=O)CC1C(=NN=C1O)C)OC

STK848258
Synonyms: 2-[4-(4-chlorophenyl)-3-methyl-1,2-oxazol-5-yl]-5-ethoxyphenol
Smiles: CCOc1ccc(c(c1)O)c1onc(c1c1ccc(cc1)Cl)C

STK574617
Synonyms: N-butyl-4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]benzamide
Smiles: CCCCNC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK848259
Synonyms: 3-(4-fluorophenyl)-8-(2-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccccc1OC)c1ccc(cc1)F

STK574618
Synonyms: 7-(4-fluorophenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione
Smiles: Fc1ccc(cc1)n1ncc2c1ncn1c2n[nH]c1=S

STK574623
Synonyms: N-{[2-(4-fluorophenyl)ethyl]carbamoyl}-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)NCCc1ccc(cc1)F)C

STK848261
Synonyms: 2-[2-amino-5-(2-methoxyphenoxy)pyrimidin-4-yl]-5-[(4-ethenylbenzyl)oxy]phenol
Smiles: COc1ccccc1Oc1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1)C=C)N

STK574628
Synonyms: (2E)-4-[(1,3-dimethyl-2,4,6-trioxo-1,1',2',3,3',3a',4,6-octahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-7'-yl)amino]-4-oxobut-2-enoicacid
Smiles: O=C(Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)/C=C/C(=O)O

STK574630
Synonyms: 2-[(4-methoxybenzyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Smiles: COc1ccc(cc1)CNc1nn2c([nH]1)nc(cc2=O)C

STK574632
Synonyms: 1-[2-(2-hydroxyphenyl)-10-(4-methoxyphenyl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: COc1ccc(cc1)C1C(=C(C)Oc2c1c1nc(nn1cn2)c1ccccc1O)C(=O)C

STK574636
Synonyms: 3-{[5,6-dimethyl-7-(4-methylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}propan-1-ol
Smiles: OCCCNc1ncnc2c1c(C)c(n2c1ccc(cc1)C)C

STK574642
Synonyms: 2-[(4-chlorophenoxy)methyl]-12-(furan-2-yl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: Clc1ccc(cc1)OCc1nc2n(n1)cnc1c2C(c2ccco2)C2=C(O1)CCCC2=O

STK574643
Synonyms: methyl2-{[(2Z)-2-(biphenyl-4-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}propanoate
Smiles: COC(=O)C(Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)c1ccccc1)/C2=O)C

STK848262
Synonyms: 3-(2-chlorophenyl)-5-methyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Cc1cc(NCc2cccnc2)n2c(n1)c(cn2)c1ccccc1Cl

STK848263
Synonyms: 7-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-ylfuran-2-carboxylate
Smiles: COc1ccc(cc1)c1cc(OC(=O)c2ccco2)cc2c1oc(=O)s2

STK574647
Synonyms: 6,7-dimethoxy-2-(propylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
Smiles: CCCS(=O)(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STK848264
Synonyms: (5-bromofuran-2-yl)[2-(4-methoxyphenyl)-6,7-dihydro[1,3]thiazolo[5,4-c]pyridin-5(4H)-yl]methanone
Smiles: COc1ccc(cc1)c1nc2c(s1)CN(CC2)C(=O)c1ccc(o1)Br

STK574666
Synonyms: N-benzyl-N-methyl-4,5,6,7-tetrahydro-2H-indazole-3-carboxamide
Smiles: CN(C(=O)c1[nH]nc2c1CCCC2)Cc1ccccc1

STK574667
Synonyms: (2S)-N-(2-chlorophenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Smiles: Clc1ccccc1NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C

STK848266
Synonyms: 4-methyl-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(Cc1cc2cccc(c2[nH]c1=O)C)CC1CCCO1

STK574671
Synonyms: 6-(3,4-dimethoxybenzyl)-7,10-dimethyl-6H-indolo[2,3-b]quinoxaline
Smiles: COc1cc(ccc1OC)Cn1c2nc3ccccc3nc2c2c1c(C)ccc2C

STK574673
Synonyms: N-{6-hydroxy-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-2-oxo-3,7-dihydro-2H-purin-8-yl}phenylalanine
Smiles: Cc1cccc(c1)OCC(Cn1c(NC(C(=O)O)Cc2ccccc2)nc2c1c(O)nc(=O)n2C)O

STK574676
Synonyms: 1'-butyl-2'-hydroxy-12-methyl-15,16-dihydro-4'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-4',6',7(1'H)-trione
Smiles: CCCCN1C(=NC(=O)C2(C1=O)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C)O

STK574677
Synonyms: 3-(4-chlorophenyl)-5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-2,6-dihydroxypyrimidin-4(3H)-one
Smiles: COc1cc2c(cc1OC)CCNC2c1c(O)nc(n(c1=O)c1ccc(cc1)Cl)O

STK574679
Synonyms: N-[(2E)-5,5-dioxido-3-(prop-2-en-1-yl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclohexanecarboxamide
Smiles: C=CCN1/C(=N\C(=O)C2CCCCC2)/SC2C1CS(=O)(=O)C2

STK574689
Synonyms: 4-imino-5-(2-methoxyphenyl)-3-[2-(morpholin-4-yl)ethyl]-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: COc1ccccc1C1c2ccc(cc2Oc2c1c(=N)n(cn2)CCN1CCOCC1)O

STK574692
Synonyms: 6-benzyl-2-phenyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Smiles: O=c1[nH]c(nc2c1CN(CC2)Cc1ccccc1)c1ccccc1

STK574695
Synonyms: methyl4-{[(3Z)-1-(2-methylpropyl)-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]amino}-4-oxobutanoate
Smiles: COC(=O)CCC(=O)/N=c/1\[nH]n(c2c1cc1ccccc1n2)CC(C)C

STK574698
Synonyms: (2E)-3-(2-chlorophenyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-[4-(propan-2-yl)benzyl]prop-2-enamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)C(C)C)/C=C/c1ccccc1Cl

STK574705
Synonyms: 2-(3,4-dimethoxyphenyl)-5-[(1-phenylethyl)amino]-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NC(c1ccccc1)C)c1ccc(c(c1)OC)OC

STK574706
Synonyms: 5-[(3,4-dichlorobenzyl)oxy]-2-[5-(2-ethoxyphenoxy)pyrimidin-4-yl]phenol
Smiles: CCOc1ccccc1Oc1cncnc1c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl

STK848269
Synonyms: N-[(2Z)-4-hydroxy-1,3-thiazol-2(5H)-ylidene]-2-[(5-phenyl[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl)sulfanyl]acetamide
Smiles: O=C(/N=C/1\SCC(=N1)O)CSc1nnc2n1c(cs2)c1ccccc1

STK574709
Synonyms: methyl4-[(3-{2-hydroxy-4-[(4-methylbenzyl)oxy]phenyl}-1H-pyrazol-4-yl)oxy]benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1c[nH]nc1c1ccc(cc1O)OCc1ccc(cc1)C

STK848270
Synonyms: 8-(2-chlorophenyl)-3-(4-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccccc1Cl)c1ccc(cc1)OC

STK574710
Synonyms: 1-(4-methylphenyl)-2-(pyridin-4-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc(cc1)C1N(Cc2ccncc2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK574711
Synonyms: 3-methyl-11-phenyl-2,3,4,11-tetrahydrodibenzo[b,e][1,4]thiazepin-1-ol
Smiles: CC1CC(=C2C(=Nc3ccccc3SC2c2ccccc2)C1)O

STK574719
Synonyms: 5-(2-hydroxy-5-methylphenyl)-N-{2-[(4-methylphenyl)carbonyl]-1-benzofuran-3-yl}-1H-pyrazole-3-carboxamide
Smiles: Cc1ccc(cc1)C(=O)c1oc2c(c1NC(=O)c1n[nH]c(c1)c1cc(C)ccc1O)cccc2

STK574725
Synonyms: quinazoline-2,4-diol
Smiles: Oc1nc2ccccc2c(n1)O

STK848271
Synonyms: N-[(2E)-4-methyl-1,3-thiazol-2(3H)-ylidene]-2-[(5-nitropyridin-2-yl)sulfanyl]acetamide
Smiles: O=C(/N=c\1/scc([nH]1)C)CSc1ccc(cn1)[N+](=O)[O-]

STK574728
Synonyms: N-[4-([1,2,4]triazolo[4,3-a]quinoxalin-4-yloxy)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)Oc1nc2ccccc2n2c1nnc2

STK574730
Synonyms: (4E)-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)-2-(2-nitrophenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1/C(=C/NCCCN2CCOCC2)/c2ccccc2C(=O)N1c1ccccc1[N+](=O)[O-]

STK574732
Synonyms: [(5S)-3-[2-(2-amino-2-oxoethoxy)phenyl]-5-(cyclohexylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]aceticacid
Smiles: OC(=O)C[C@]1(ON=C(C1)c1ccccc1OCC(=O)N)C(=O)NC1CCCCC1

STK574733
Synonyms: 3-amino-6-hydroxy-4-phenyl-4,5-dihydrothieno[2,3-b]pyridine-2-carboxamide
Smiles: OC1=Nc2sc(c(c2C(C1)c1ccccc1)N)C(=O)N

STK574734
Synonyms: 4-methoxy-N-(tetrahydrofuran-2-ylmethyl)-1H-indole-2-carboxamide
Smiles: COc1cccc2c1cc([nH]2)C(=O)NCC1CCCO1

STK848272
Synonyms: 1-[(2Z)-5-(ethylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)urea
Smiles: CCSc1n[nH]/c(=N/C(=O)NC(C(F)(F)F)(C(F)(F)F)C)/s1

STK848273
Synonyms: (2Z)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/c1cc(Br)c(c(c1)OC)O)/c1scc(n1)c1ccc(cc1)Br

STK574735
Synonyms: 2-[(1E)-1-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)ethyl]hydrazinecarboxamide
Smiles: NC(=O)NN/C(=C/1\C(=NC(=NC1=O)O)O)/C

STK574737
Synonyms: 8-(3-chlorophenyl)-10-methyl-11-(pyridin-3-yl)-2-(thiophen-2-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1cccc(c1)n1nc(c2c1Oc1ncn3c(c1C2c1cccnc1)nc(n3)c1cccs1)C

STK848274
Synonyms: 1-(3-methoxypropyl)-N-(3-methylbutyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)NCCC(C)C

STK574738
Synonyms: 2-(4-ethylpiperazin-1-yl)-5,6,7,8-tetrahydroquinazolin-4-ol
Smiles: CCN1CCN(CC1)c1nc(O)c2c(n1)CCCC2

STK574739
Synonyms: 2-[2-amino-5-(2-bromophenoxy)-6-methylpyrimidin-4-yl]-5-[(3,4-dichlorobenzyl)oxy]phenol
Smiles: Nc1nc(C)c(c(n1)c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl)Oc1ccccc1Br

STK574741
Synonyms: methylN-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}tryptophanate
Smiles: C=CCN1C(=NC(=O)/C(=C\NC(C(=O)OC)Cc2c[nH]c3c2cccc3)/C1=O)S

STK574744
Synonyms: 12-(3,4-dimethoxyphenyl)-2-(pyridin-3-yl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: COc1ccc(cc1OC)C1C2=C(CCCC2=O)Oc2c1c1nc(nn1cn2)c1cccnc1

STK574746
Synonyms: (4E,5Z)-4-[(4-ethoxyphenyl)imino]-5-(4-hydroxy-3-methoxybenzylidene)-4,5-dihydro-1,3-thiazol-2-ol
Smiles: CCOc1ccc(cc1)/N=C\1/N=C(S/C1=C\c1ccc(c(c1)OC)O)O

STK848276
Synonyms: 3-(2-ethoxyphenoxy)-2-methyl-4-oxo-4H-chromen-7-ylcyclopropanecarboxylate
Smiles: CCOc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OC(=O)C1CC1

STK574751
Synonyms: 4-[(4-benzylpiperazin-1-yl)methyl]-6,7-dimethyl-2H-chromen-2-one
Smiles: O=c1cc(CN2CCN(CC2)Cc2ccccc2)c2c(o1)cc(c(c2)C)C

STK574758
Synonyms: 2,12-diphenyl-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: O=C1CCCC2=C1C(c1ccccc1)c1c(O2)ncn2c1nc(n2)c1ccccc1

STK574760
Synonyms: (2Z)-6-[(4-bromobenzyl)oxy]-2-(2H-chromen-3-ylmethylidene)-1-benzofuran-3(2H)-one
Smiles: Brc1ccc(cc1)COc1ccc2c(c1)O/C(=C\C1=Cc3c(OC1)cccc3)/C2=O

STK574764
Synonyms: (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(propan-2-yl)phenyl]propanamide
Smiles: O=C([C@@H](n1cnc2c(c1=O)cccc2)C)Nc1ccc(cc1)C(C)C

STK574768
Synonyms: (4E)-2-(2-chlorophenyl)-4-({[(1-ethylpyrrolidin-2-yl)methyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccccc1Cl

STK574771
Synonyms: 2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK848280
Synonyms: 3-(2,4-dimethoxyphenyl)-8-(4-fluorophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)F)c1ccc(cc1OC)OC

STK574775
Synonyms: 5-[(2-methoxybenzyl)amino]-2-(morpholin-4-ium-4-yl)benzoate
Smiles: COc1ccccc1CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK848282
Synonyms: ethyl{[(2Z)-2-(furan-2-ylmethylidene)-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1C)O/C(=C\c1ccco1)/C2=O

STK848283
Synonyms: N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]propanamide
Smiles: CCC(=O)Nc1nonc1c1ccc(c(c1)OC)OC

STK574786
Synonyms: ethyl1-[(5-methoxy-3-methyl-1H-indol-2-yl)carbonyl]piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)C(=O)c1[nH]c2c(c1C)cc(cc2)OC

STK848285
Synonyms: 1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-prop-2-en-1-ylurea
Smiles: C=CCNC(=O)NC1(C)CCS(=O)(=O)C1

STK574791
Synonyms: 3-(3-hydroxypropyl)-1-methyl-8-(4-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)C

STK574794
Synonyms: ethyl5-amino-1-[3-(2-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]-1H-pyrazole-4-carboxylate
Smiles: CCOC(=O)c1cnn(c1N)c1cc(C)nc2n1nc(c2c1ccccc1OC)C

STK574800
Synonyms: N-[(2-chlorobenzyl)carbamoyl]-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)NCc1ccccc1Cl)C

STK574801
Synonyms: (5E)-5-[(6-chloro-4-oxo-4H-chromen-3-yl)methylidene]-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C\c2coc3c(c2=O)cc(cc3)Cl)/C1=O)O

STK848286
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-N-(2-phenylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(cc2NCCc1ccccc1)C(C)(C)C

STK848289
Synonyms: 3-(4-chlorophenyl)-5-methyl-N-(2-phenylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)cc2NCCc1ccccc1

STK574805
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[methyl(phenyl)amino]methyl}-N'-[(1E)-1-(pyridin-2-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CN(c1ccccc1)C)C(=O)N/N=C(/c1ccccn1)\C

STK574810
Synonyms: 1-(3-methoxypropyl)-4-oxo-N-[3-(propan-2-yloxy)propyl]-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)NCCCOC(C)C

STK574813
Synonyms: 7-[4-(diphenylmethyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Cc1cc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)n2c(n1)ncn2

STK574815
Synonyms: 7,9-dimethoxy[1,2,4]triazino[4,5-a]indol-1-ol
Smiles: COc1cc(OC)cc2c1cc1n2cnnc1O

STL036512
Synonyms: N-[(2Z)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]-6,7-dimethyl-4-oxo-4H-chromene-2-carboxamide
Smiles: COc1ccc2c(c1)s/c(=N\C(=O)c1cc(=O)c3c(o1)cc(c(c3)C)C)/[nH]2

STK574830
Synonyms: 7-chloro-1-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-[3-(propan-2-yloxy)propyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cc(ccc1O)C1N(CCCOC(C)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK574834
Synonyms: 6-(azepanium-1-ylmethyl)-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCCCC1)oc(=O)c1c2CCC1

STK848295
Synonyms: 4-[3-(4-chlorophenyl)-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazol-5-yl]-N,N-dimethylaniline
Smiles: Clc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)N(C)C)S(=O)(=O)C

STK848296
Synonyms: N,1-bis(3-methoxypropyl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCNC(=O)c1cc2c(n1CCCOC)nc1n(c2=O)cccc1C

STK574837
Synonyms: 4-{(E)-[5-iminio-7-oxo-2-(pyridin-4-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}benzoate
Smiles: O=C1N=c2sc(nn2C(=[NH2+])/C/1=C\c1ccc(cc1)C(=O)[O-])c1ccncc1

STK574840
Synonyms: 2-[2-oxo-2-(3,3,5,5-tetramethyl-1,3,4,5-tetrahydro-2H-2-benzazepin-2-yl)ethyl]-1,2-benzothiazol-3(2H)-one1,1-dioxide
Smiles: O=C(N1Cc2ccccc2C(CC1(C)C)(C)C)CN1C(=O)c2c(S1(=O)=O)cccc2

STK574841
Synonyms: 4-amino-N-(4-methoxybenzyl)-3-phenyl-2-thioxo-2,3-dihydro-1,3-thiazole-5-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1sc(=S)n(c1N)c1ccccc1

STK848299
Synonyms: 2-[2-amino-5-(3-methoxyphenoxy)pyrimidin-4-yl]-5-[(2,5-dimethylbenzyl)oxy]phenol
Smiles: COc1cccc(c1)Oc1cnc(nc1c1ccc(cc1O)OCc1cc(C)ccc1C)N

STK574845
Synonyms: (2Z)-6-[(4-bromobenzyl)oxy]-2-(pyridin-4-ylmethylidene)-1-benzofuran-3(2H)-one
Smiles: Brc1ccc(cc1)COc1ccc2c(c1)O/C(=C\c1ccncc1)/C2=O

STK574851
Synonyms: 5-[(2-chlorobenzyl)oxy]-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]phenol
Smiles: COc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1ccccc1Cl

STK574852
Synonyms: 5-cyano-4-(furan-2-yl)-2-methyl-6-{[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl}-N-(4-sulfamoylphenyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)NC(=C(C1c1ccco1)C(=O)Nc1ccc(cc1)S(=O)(=O)N)C

STK574854
Synonyms: [(5E)-5-(3,4-dihydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl](phenyl)aceticacid
Smiles: OC(=O)C(N1C(=S)S/C(=C/c2ccc(c(c2)O)O)/C1=O)c1ccccc1

STK574859
Synonyms: N-(4-chlorophenyl)-2-hydroxy-5-oxo-7-phenyl-3,4,5,6,7,8-hexahydroquinoline-4-carboxamide
Smiles: OC1=NC2=C(C(C1)C(=O)Nc1ccc(cc1)Cl)C(=O)CC(C2)c1ccccc1

STK574864
Synonyms: (1Z)-6,7-dimethoxy-1-{[(4-methoxyphenyl)sulfonyl]methylidene}-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1ccc(cc1)S(=O)(=O)/C=C/1\NCCc2c1cc(OC)c(c2)OC

STK574867
Synonyms: 1-benzyl-N-(3,4-dimethoxyphenyl)-7-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cc(cc1)C

STK848300
Synonyms: N-(4-fluorophenyl)-2,8,10-trimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-4-amine
Smiles: Fc1ccc(cc1)Nc1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK574869
Synonyms: 2-(2-amino-5-phenylpyrimidin-4-yl)-5-[(3,4-dichlorobenzyl)oxy]phenol
Smiles: Nc1ncc(c(n1)c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl)c1ccccc1

STK574871
Synonyms: 6-hydroxy-7-(2-hydroxyethyl)-3-methyl-8-[(3-methylbutyl)amino]-3,7-dihydro-2H-purin-2-one
Smiles: OCCn1c(NCCC(C)C)nc2c1c(O)nc(=O)n2C

STK574874
Synonyms: (4E)-2-(2-methoxyphenyl)-4-{[(pyridin-2-ylmethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccccc1N1C(=O)/C(=C/NCc2ccccn2)/c2c(C1=O)cccc2

STK574881
Synonyms: N-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-L-phenylalanyl-L-alanine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccccc1

STK574884
Synonyms: 6-amino-1-(4-fluorobenzyl)-2-sulfanylpyrimidin-4(1H)-one
Smiles: Fc1ccc(cc1)Cn1c(N)cc(=O)nc1S

STK848302
Synonyms: 3-(3-hydroxypropyl)-1,6,7-trimethyl-8-(2-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)c1ccccc1C

STK574887
Synonyms: 2-(1H-benzimidazol-2-yl)-4-chloro-5-{[2-(2,4-dichlorophenyl)ethyl]amino}pyridazin-3(2H)-one
Smiles: Clc1ccc(c(c1)Cl)CCNc1cnn(c(=O)c1Cl)c1nc2c([nH]1)cccc2

STK574888
Synonyms: N-[2',6'-dihydroxy-3-(2-methoxyphenyl)-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl]acetamide
Smiles: COc1ccccc1N1CCN2C(C1)C1(Cc3c2ccc(c3)NC(=O)C)C(=NC(=NC1=O)O)O

STK574894
Synonyms: 2-(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)-N-[2-(morpholin-4-yl)ethyl]acetamide
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)NCCN1CCOCC1

STK574896
Synonyms: (5Z)-1-(3-chlorophenyl)-5-[5-(thiophen-2-yl)pyrazolidin-3-ylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1cccc(c1)N1C(=O)NC(=O)/C(=C\2/NNC(C2)c2cccs2)/C1=O

STK574900
Synonyms: 5,6-dimethyl-N-[3-(morpholin-4-yl)propyl]furo[2,3-d]pyrimidin-4-amine
Smiles: Cc1c(C)oc2c1c(NCCCN1CCOCC1)ncn2

STK574910
Synonyms: (4E)-4-(2,3-dihydro-1,4-benzodioxin-6-ylimino)-6-[(4-methylpiperazin-1-yl)methyl]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: CN1CCN(CC1)Cc1nc(N)n/c(=N/c2ccc3c(c2)OCCO3)/[nH]1

STK574914
Synonyms: 5-(2-hydroxy-4,5-dimethylphenyl)-N-{4-[methyl(phenyl)sulfamoyl]phenyl}-1H-pyrazole-3-carboxamide
Smiles: O=C(c1n[nH]c(c1)c1cc(C)c(cc1O)C)Nc1ccc(cc1)S(=O)(=O)N(c1ccccc1)C

STK848308
Synonyms: 3-(4-methoxyphenoxy)-2-methyl-4-oxo-4H-chromen-7-ylcyclopropanecarboxylate
Smiles: COc1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OC(=O)C1CC1

STK574918
Synonyms: 7-(3,5-dimethylphenyl)-3-(2-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Cc1cc(C)cc(c1)n1ncc2c1ncn1c2nnc1c1ccccc1C

STK574919
Synonyms: 1-[2-(3,4-dimethoxyphenyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2)OC(=C(C1c1ccco1)C(=O)C)C

STK574920
Synonyms: 6-chloro-4-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-7-methyl-2H-chromen-2-one
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1cc(=O)oc2c1cc(Cl)c(c2)C

STK574921
Synonyms: (5E)-5-{[(4-fluorophenyl)amino]methylidene}-2-hydroxy-1-phenylpyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)N/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1)O

STK574923
Synonyms: 6-amino-5-bromo-4-hydroxy-1-phenylpyrimidin-2(1H)-one
Smiles: Oc1nc(=O)n(c(c1Br)N)c1ccccc1

STK574925
Synonyms: ethyl4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidine-1-carboxylate
Smiles: CCOC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1

STK574928
Synonyms: 12-(furan-2-yl)-2-(thiophen-2-yl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: O=C1CCCC2=C1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1cccs1

STK574931
Synonyms: 3-[chloro(phenyl)methyl]quinoxalin-2-ol
Smiles: Oc1nc2ccccc2nc1C(c1ccccc1)Cl

STK574932
Synonyms: 5-[(4-fluorobenzyl)oxy]-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]phenol
Smiles: COc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1ccc(cc1)F

STK574936
Synonyms: 4-(4-ethylpiperazin-1-yl)-2-phenyl[1]benzofuro[3,2-d]pyrimidine
Smiles: CCN1CCN(CC1)c1nc(nc2c1oc1c2cccc1)c1ccccc1

STK574943
Synonyms: 4-hydroxy-8-(4-methoxybenzyl)-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: COc1ccc(cc1)Cn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK574945
Synonyms: N-[(2-methylpiperidin-1-yl)carbonyl]-L-phenylalanine
Smiles: OC(=O)[C@@H](NC(=O)N1CCCCC1C)Cc1ccccc1

STK848313
Synonyms: 5-(furan-2-ylmethyl)-3-(2-hydroxyphenyl)-4-[4-(methylsulfanyl)phenyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: CSc1ccc(cc1)C1N(Cc2ccco2)C(=O)c2c1c([nH]n2)c1ccccc1O

STK574953
Synonyms: 2-chloro-N'-{(Z)-[2-hydroxy-1-(2-methylphenyl)-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}benzohydrazide
Smiles: O=C1N=C(O)N(C(=O)/C/1=C\NNC(=O)c1ccccc1Cl)c1ccccc1C

STK848316
Synonyms: 1-benzyl-N-(2-fluorophenyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: Fc1ccccc1NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK574959
Synonyms: 6-hydroxy-1',6'-dimethyl-3-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: CCCN1C(=O)N=C(C2(C1=O)CN(C)c1c(C2)cc(cc1)C)O

STK848317
Synonyms: 3-(furan-2-ylmethyl)-8-(4-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)C)Cc1ccco1

STK574962
Synonyms: 2-(1,3-benzothiazol-2-ylamino)-6-(propan-2-yl)pyrimidin-4-ol
Smiles: Oc1nc(Nc2nc3c(s2)cccc3)nc(c1)C(C)C

STK574964
Synonyms: (2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-N-phenylethanethioamide
Smiles: COc1cc2/C(=C/C(=S)Nc3ccccc3)/NCCc2cc1OC

STK574966
Synonyms: 2-[(7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)sulfanyl]-1-(morpholin-4-yl)ethanone
Smiles: O=C(N1CCOCC1)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK574972
Synonyms: N-[4-(4-acetylpiperazin-1-yl)phenyl]-5-chloro-1H-indole-2-carboxamide
Smiles: Clc1ccc2c(c1)cc([nH]2)C(=O)Nc1ccc(cc1)N1CCN(CC1)C(=O)C

STK848321
Synonyms: 4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]-N-phenylpiperazine-1-carboxamide
Smiles: O=C(N1CCN(CC1)Cc1nc2c(n1C)ccc(c2)[N+](=O)[O-])Nc1ccccc1

STK848322
Synonyms: 3-(2-methoxyphenyl)-2,5-dimethyl-N-[2-(morpholin-4-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COc1ccccc1c1c(C)nn2c1nc(C)cc2NCCN1CCOCC1

STK574977
Synonyms: N-(9-ethyl-9H-carbazol-3-yl)-4-hydroxy-3,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: CCn1c2ccc(cc2c2c1cccc2)NC(=O)c1oc2c(c1C)C(O)CC(C2)(C)C

STK848326
Synonyms: 5-(2-hydroxyethyl)-3-(2-hydroxyphenyl)-4-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCN1C(c2ccccc2)c2c(C1=O)n[nH]c2c1ccccc1O

STK574980
Synonyms: 5-(4-ethoxyphenyl)-4-{(2E)-2-[(5-methylfuran-2-yl)methylidene]hydrazinyl}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1N/N=C/c1ccc(o1)C

STK574981
Synonyms: 9-(3,4-dichlorophenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nc2n(n1)C(c1ccc(c(c1)Cl)Cl)C1=C(O)CCCC1=N2

STK574984
Synonyms: N-[(1Z)-1-{1-cyano-2-[(2-methylpropyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]thiophene-2-carboxamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cccs1)/C(=O)NCC(C)C

STK574988
Synonyms: 6-chloro-4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-7-methyl-2H-chromen-2-one
Smiles: OCCN1CCN(CC1)Cc1cc(=O)oc2c1cc(Cl)c(c2)C

STK574989
Synonyms: 5-(2-hydroxy-3,4-dimethylphenyl)-N-{4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl}-1H-pyrazole-3-carboxamide
Smiles: Cc1ccnc(n1)NS(=O)(=O)c1ccc(cc1)NC(=O)c1n[nH]c(c1)c1ccc(c(c1O)C)C

STK574991
Synonyms: 5-hydroxy-2-[({4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl}carbonyl)amino]benzoicacid
Smiles: Oc1ccc(c(c1)C(=O)O)NC(=O)c1ccc(cc1)/C=C/1\SC(=S)N(C1=O)C

STK574995
Synonyms: 12-(furan-2-yl)-2-(4-methylphenyl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: Cc1ccc(cc1)c1nc2n(n1)cnc1c2C(c2ccco2)C2=C(O1)CCCC2=O

STK574999
Synonyms: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl)sulfanyl]-N-(3,4-dimethoxyphenyl)acetamide
Smiles: N#Cc1cc2CN(C)CCc2nc1SCC(=O)Nc1ccc(c(c1)OC)OC

STK848327
Synonyms: 2-(azepan-1-ylcarbonyl)-1-(3-methoxypropyl)pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: COCCCn1c(cc2c1nc1ccccn1c2=O)C(=O)N1CCCCCC1

STK575004
Synonyms: 5-(2-hydroxy-3,4-dimethylphenyl)-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1O)C)C)NCc1ccncc1

STK575007
Synonyms: 2-chloro-N'-{(Z)-[1-(3-chlorophenyl)-2-hydroxy-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}benzohydrazide
Smiles: Clc1cccc(c1)N1C(=NC(=O)/C(=C/NNC(=O)c2ccccc2Cl)/C1=O)O

STK575015
Synonyms: 5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(5-fluoro-2-hydroxyphenyl)-4-(4-fluorophenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1OC)CCN1C(=O)c2c(C1c1ccc(cc1)F)c([nH]n2)c1cc(F)ccc1O

STK575027
Synonyms: 2,2'-[(2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)imino]diethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C)CCO

STK575028
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-5-(2-hydroxyethyl)-4-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCN1C(=O)c2c(C1c1ccccc1)c([nH]n2)c1cc(Cl)c(cc1O)C

STK848331
Synonyms: 3-(2-chlorophenyl)-N-(2-methoxyethyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COCCNc1cc(C)nc2n1nc(c2c1ccccc1Cl)C

STK575033
Synonyms: 6,7-dimethoxy-N-(3-methoxyphenyl)-1-methyl-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Smiles: COc1cccc(c1)NC(=S)N1CCc2c(C1C)cc(c(c2)OC)OC

STK575036
Synonyms: 4-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-6,7-dimethyl-2H-chromen-2-one
Smiles: O=c1cc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(o1)cc(c(c2)C)C

STK575038
Synonyms: N-[2-(2-acetyl-4,5-dimethoxyphenyl)ethyl]-2,3,5,6-tetramethylbenzenesulfonamide
Smiles: COc1cc(CCNS(=O)(=O)c2c(C)c(C)cc(c2C)C)c(cc1OC)C(=O)C

STK848333
Synonyms: 4-oxo-N-{3-[(tetrahydrofuran-2-ylmethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4H-chromene-2-carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)Nc1sc2c(c1C(=O)NCC1CCCO1)CCCC2

STK848335
Synonyms: 3-(2,4-dimethoxyphenyl)-8-(4-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: COc1ccc(cc1)C1CC(=O)N2C(=C1C#N)SCN(C2)c1ccc(cc1OC)OC

STK575042
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-N-(3,5-dimethylphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Clc1ccc(cc1)c1c(C)nn2c1nc(cc2Nc1cc(C)cc(c1)C)C(C)(C)C

STK575043
Synonyms: 2-[2-amino-5-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]-5-[(4-methylbenzyl)oxy]phenol
Smiles: Cc1ccc(cc1)COc1ccc(c(c1)O)c1nc(N)nc(c1c1ccccc1)C(F)(F)F

STK575044
Synonyms: 4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(pyridin-3-ylmethyl)butanamide
Smiles: COc1ccccc1c1noc(n1)CCCC(=O)NCc1cccnc1

STK575049
Synonyms: [(4Z)-4-(hydroxyimino)-3,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-2-yl](morpholin-4-yl)methanone
Smiles: O/N=C\1/CC(C)(C)Cc2c1c(C)c(o2)C(=O)N1CCOCC1

STK575050
Synonyms: 5-(2-hydroxyphenyl)-N-{3-[(2-methoxyethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1H-pyrazole-3-carboxamide
Smiles: COCCNC(=O)c1c(NC(=O)c2n[nH]c(c2)c2ccccc2O)sc2c1CCCC2

STK575052
Synonyms: 9-{(E)-[2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazinylidene]methyl}-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-8-ol
Smiles: Oc1c(/C=N/Nc2ncnc3c2c(cs3)c2ccccc2)cc2c3c1CCCN3CCC2

STK575053
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)Nc1cccc(c1)NC(=O)C)C

STK575055
Synonyms: 3-cyclopentyl-N-[(2Z)-5,5-dioxido-3-(2-phenylethyl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide
Smiles: O=C(/N=C/1\SC2C(N1CCc1ccccc1)CS(=O)(=O)C2)CCC1CCCC1

STK848339
Synonyms: ethyl[3-(4-chlorophenyl)-7-hydroxy-5-methylpyrazolo[1,5-a]pyrimidin-6-yl]acetate
Smiles: CCOC(=O)Cc1c(C)nc2n(c1O)ncc2c1ccc(cc1)Cl

STK848340
Synonyms: 1-benzyl-N-(2-methoxy-5-methylphenyl)-7-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COc1ccc(cc1NC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cc(cc1)C)C

STK848341
Synonyms: 2-chloropyrido[1,2-b][2,4]benzodiazepin-6(11H)-imine
Smiles: Clc1ccc2=NC(=N)c3c(Cn2c1)cccc3

STK575061
Synonyms: 2-amino-5-(1,3-benzodioxol-5-yl)-6-hydroxy-8,8-dimethyl-5,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Smiles: Nc1nc2N=C3CC(C)(C)CC(=C3C(c2c(=O)[nH]1)c1ccc2c(c1)OCO2)O

STK575063
Synonyms: N-[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: CC(=O)/N=C/1\SC2C(N1Cc1ccc3c(c1)OCO3)CS(=O)(=O)C2

STK575065
Synonyms: 7-(4-benzylpiperazin-1-yl)-3-(2-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidine
Smiles: Cc1cc(N2CCN(CC2)Cc2ccccc2)n2c(n1)c(cn2)c1ccccc1Cl

STK575066
Synonyms: 1-[2-(3,4-dimethoxyphenyl)ethyl]-9'-fluoro-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(=O)C2(C1=O)Cc1cccc(c1N1C2CCC1)F

STK575068
Synonyms: 6-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]hexanoicacid
Smiles: Cc1c(C)sc2c1c(NCCCCCC(=O)O)ncn2

STK575070
Synonyms: (4Z)-4-[(3-chloro-4-methylphenyl)imino]-6-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Nc1nc(CN2CCN(CC2)c2cccc(c2)C(F)(F)F)[nH]/c(=N/c2ccc(c(c2)Cl)C)/n1

STK848344
Synonyms: 6-methyl-N-{4-[methyl(phenyl)sulfamoyl]phenyl}-4-oxo-4H-chromene-2-carboxamide
Smiles: Cc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc1ccc(cc1)S(=O)(=O)N(c1ccccc1)C

STK575077
Synonyms: 2-[(3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-cyclopropylacetamide
Smiles: O=C(NC1CC1)COc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1

STK575082
Synonyms: 7-cyclohexyl-N~5~-(tetrahydrofuran-2-ylmethyl)-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridine-1,5-diamine
Smiles: Nc1n[nH]c2c1c1CCN(Cc1c(n2)NCC1CCCO1)C1CCCCC1

STK848345
Synonyms: N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]-3-methylbutanamide
Smiles: CC(CC(=O)Nc1nonc1c1ccc(cc1)Cl)C

STK575091
Synonyms: 2-benzyl-7-chloro-1-(3-ethoxy-4-hydroxyphenyl)-6-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cc(ccc1O)C1N(Cc2ccccc2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK575092
Synonyms: N-(2,5-dimethoxyphenyl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide
Smiles: COc1ccc(c(c1)NC(=O)c1n[nH]c(c1)c1cc(C)cc(c1O)C)OC

STK575093
Synonyms: 1-(3-chlorophenyl)-7-fluoro-2-(2-hydroxyethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)Cl)c(=O)c1c(o2)ccc(c1)F

STK848347
Synonyms: 2-{2-[(3,5-diphenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethoxy}ethanol
Smiles: OCCOCCNc1cc(nc2n1ncc2c1ccccc1)c1ccccc1

STK575097
Synonyms: 5-methyl-N-(2-methylpropyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CC(CNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2)C

STK575098
Synonyms: methylN-(azepan-1-ylcarbonyl)-D-phenylalaninate
Smiles: COC(=O)[C@H](NC(=O)N1CCCCCC1)Cc1ccccc1

STK575100
Synonyms: tert-butyl(3S)-3-{[(2S)-3-methyl-1-oxo-1-(propylamino)butan-2-yl]carbamoyl}-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: CCCNC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK575107
Synonyms: N-[(3,4-dimethoxybenzyl)carbamoyl]-L-valine
Smiles: COc1cc(CNC(=O)N[C@H](C(=O)O)C(C)C)ccc1OC

STK575110
Synonyms: 7-methyl-4-[(4-methylpiperazin-1-ium-1-yl)methyl]-2-oxo-2H-chromen-6-olate
Smiles: CN1CC[NH+](CC1)Cc1cc(=O)oc2c1cc([O-])c(c2)C

STK575114
Synonyms: N-(4-phenyl-1,2,5-oxadiazol-3-yl)-3-propoxybenzamide
Smiles: CCCOc1cccc(c1)C(=O)Nc1nonc1c1ccccc1

STK575115
Synonyms: N-(5-hydroxy-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-2-methylbenzamide
Smiles: Oc1cc(NC(=O)c2ccccc2C)n2c(n1)nc(n2)c1ccccc1

STK848348
Synonyms: 1-(3-methoxypropyl)-9-methyl-N-(3-methylbutyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCCC(C)C

STK575121
Synonyms: 2-methoxy-1-(1-methyl-1H-benzimidazol-2-yl)-1-phenylethanamine
Smiles: COCC(c1nc2c(n1C)cccc2)(c1ccccc1)N

STK575122
Synonyms: 1-methyl-2-(piperazin-1-yl)-1H-benzimidazole
Smiles: Cn1c(nc2c1cccc2)N1CCNCC1

STK575123
Synonyms: 2-[(5Z)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2)/C1=O)NCCc1c[nH]c2c1cccc2

STK575131
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2c2ccccc2F)cc(c1OC)OC

STK575132
Synonyms: 2-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-N-(4-methylphenyl)acetamide
Smiles: COc1cc2c(cc1OC)CCN(C2C)CC(=O)Nc1ccc(cc1)C

STK575133
Synonyms: (4Z)-4-[(4-ethoxyphenyl)imino]-6-[(4-phenylpiperazin-1-yl)methyl]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: CCOc1ccc(cc1)/N=c/1\nc(N)nc([nH]1)CN1CCN(CC1)c1ccccc1

STK575137
Synonyms: 12-(4-fluorophenyl)-3-methyl-2,3,4,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1-ol
Smiles: CC1CC(=C2C(=Nc3n(C2c2ccc(cc2)F)c2c(n3)cccc2)C1)O

STK575143
Synonyms: 8-methyl[1,2,4]triazino[4,5-a]indol-1-ol
Smiles: Cc1ccc2c(c1)cc1n2cnnc1O

STK575145
Synonyms: {[(2Z)-2-(furan-2-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}aceticacid
Smiles: OC(=O)COc1ccc2c(c1)O/C(=C\c1ccco1)/C2=O

STK848353
Synonyms: 1-(2-chlorobenzyl)-2-(3,4-dimethoxyphenyl)-1H-benzimidazole
Smiles: COc1cc(ccc1OC)c1nc2c(n1Cc1ccccc1Cl)cccc2

STK575153
Synonyms: ethyl2-{[(6-chloro-7-methyl-4-oxo-4H-chromen-2-yl)carbonyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)sc(c1C)C

STK575154
Synonyms: 6-chloro-4-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-2H-chromen-2-one
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1cc(=O)oc2c1cc(Cl)cc2

STK801759
Synonyms: ethyl4-(3-formyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1nc2ccccn2c(=O)c1C=O

STK575157
Synonyms: 8-(2-methoxyphenyl)-1-methyl-3-(2-phenylethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK848354
Synonyms: 8-(4-ethylphenyl)-3-(2-methoxyethyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccc(cc1)CC)C

STK575164
Synonyms: 5-({[(5Z)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}amino)-2-hydroxybenzoicacid
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2)/C1=O)Nc1ccc(c(c1)C(=O)O)O

STK848357
Synonyms: 3-(3-methylphenyl)-6-oxo-8-(2,4,5-trimethoxyphenyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1cc(OC)c(cc1OC)OC)c1cccc(c1)C

STK848358
Synonyms: 1-benzyl-N-(2-methoxyethyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCNC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK575167
Synonyms: ethyl1-[(7-methyl-2-oxo-2H-chromen-4-yl)methyl]piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2)C

STK848359
Synonyms: N-benzyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]pyridine-4-carboxamide
Smiles: O=C(N(Cc1cc2ccccc2[nH]c1=O)Cc1ccccc1)c1ccncc1

STK575173
Synonyms: 1-[2-(2-methoxyphenyl)-10-(4-methoxyphenyl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: COc1ccc(cc1)C1C(=C(C)Oc2c1c1nc(nn1cn2)c1ccccc1OC)C(=O)C

STK575176
Synonyms: N-[(2E)-3-(3-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide
Smiles: CCC(=O)/N=C\1/SC2C(N1Cc1cccc(c1)OC)CS(=O)(=O)C2

STK575177
Synonyms: (5E)-3-cyclopentyl-5-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CC1Oc2c(C1)cc(cc2)/C=C\1/SC(=S)N(C1=O)C1CCCC1

STK575178
Synonyms: N-(2-chlorophenyl)-5-(2-hydroxy-3,5-dimethylphenyl)-1H-pyrazole-3-carboxamide
Smiles: Cc1cc(C)c(c(c1)c1[nH]nc(c1)C(=O)Nc1ccccc1Cl)O

STK848362
Synonyms: 4-(3,4-dichlorophenyl)-3-(2-hydroxyphenyl)-5-[2-(4-methoxyphenyl)ethyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(c(c1)Cl)Cl)c([nH]n2)c1ccccc1O

STK575183
Synonyms: 5-[(3-chlorobenzyl)oxy]-2-[5-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]phenol
Smiles: COc1ccc(cc1)c1c(ncnc1C(F)(F)F)c1ccc(cc1O)OCc1cccc(c1)Cl

STK575188
Synonyms: 3-[3-(pyrazin-2-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]benzoicacid
Smiles: OC(=O)c1cccc(c1)n1c(=S)[nH]nc1c1cnccn1

STK575189
Synonyms: 4-chloro-N'-{4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1ccc(cc1)Cl)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK575192
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methylbenzyl)benzamide
Smiles: CCOc1ccccc1C(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)C

STK575195
Synonyms: 5-(2-hydroxy-5-methylphenyl)-N-{3-[(tetrahydrofuran-2-ylmethyl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}-1H-pyrazole-3-carboxamide
Smiles: Cc1ccc(c(c1)c1[nH]nc(c1)C(=O)Nc1sc2c(c1C(=O)NCC1CCCO1)CCC2)O

STK848365
Synonyms: 1,3-dimethyl-8-(4-methylpiperidin-1-yl)-7-{2-[(4-methylpyrimidin-2-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCN(CC1)c1nc2c(n1CCSc1nccc(n1)C)c(=O)n(c(=O)n2C)C

STK575196
Synonyms: (5E)-5-(4-fluorobenzylidene)-2-imino-1-methyl-2,5-dihydro-1H-imidazol-4-ol
Smiles: CN1C(=N)N=C(/C/1=C\c1ccc(cc1)F)O

STK575197
Synonyms: N-[(2S)-1-(butylamino)-4-(methylsulfanyl)-1-oxobutan-2-yl]-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: CSCC[C@@H](C(=O)NCCCC)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

STK575198
Synonyms: 3,5-diphenyl-N-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CC(Nc1cc(nc2n1ncc2c1ccccc1)c1ccccc1)C

STK575201
Synonyms: 3-butyl-7-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCCCn1cnc2c(c1=O)[nH]c1c2ccc(c1)OC

STK848369
Synonyms: N-[(2Z)-5-ethyl-4-phenyl-1,3-thiazol-2(3H)-ylidene]-3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanamide
Smiles: CCc1s/c(=N\C(=O)CCn2c(=O)oc3c2cccc3)/[nH]c1c1ccccc1

STK575215
Synonyms: N-[2-(morpholin-4-yl)ethyl]-2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: O1CCN(CC1)CCNc1nc(nc2c1oc1c2cccc1)c1ccccc1

STK575228
Synonyms: 6-amino-1-(2-chlorobenzyl)-4-hydroxypyrimidin-2(1H)-one
Smiles: Oc1cc(N)n(c(=O)n1)Cc1ccccc1Cl

STK848370
Synonyms: 2-amino-5-(1,3-benzodioxol-5-yl)-4-hydroxy-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C1Nc2nc(N)nc(c2C(C1)c1ccc2c(c1)OCO2)O

STK575231
Synonyms: 2-hydroxy-4-({[(5Z)-5-(3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}amino)benzoicacid
Smiles: COc1cccc(c1)/C=C/1\SC(=S)N(C1=O)CC(=O)Nc1ccc(c(c1)O)C(=O)O

STK575235
Synonyms: 1'-(2-chlorobenzyl)-1-ethyl-2-methyl-2H,2'H,4H-spiro[dipyrido[1,2-a:2',3'-d]pyrimidine-3,5'-pyrimidine]-2',4',5,6'(1H,1'H,3'H)-tetrone
Smiles: CCN1c2nc3ccccn3c(=O)c2CC2(C1C)C(=O)NC(=O)N(C2=O)Cc1ccccc1Cl

STK575236
Synonyms: 2-chloro-N'-{(Z)-[1-(3,4-dimethylphenyl)-2-hydroxy-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}benzohydrazide
Smiles: O=C1N=C(O)N(C(=O)/C/1=C\NNC(=O)c1ccccc1Cl)c1ccc(c(c1)C)C

STK575238
Synonyms: 4-[({[4-(4-methoxyphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)O)nnc1c1cccs1

STK575240
Synonyms: 2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-N-(pyridin-3-ylmethyl)acetamide
Smiles: O=C(COc1cc2oc(=O)cc(c2cc1Cl)c1ccccc1)NCc1cccnc1

STK848373
Synonyms: 2-[2-amino-5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol
Smiles: COc1ccc(cc1OC)c1cnc(nc1c1ccc(cc1O)OCc1c(F)cccc1Cl)N

STK575242
Synonyms: 3-(3-chlorophenyl)-4-ethyl-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazole
Smiles: CCn1c(SCc2cccc(c2)C(F)(F)F)nnc1c1cccc(c1)Cl

STK575245
Synonyms: 12-(furan-2-yl)-9,9-dimethyl-2-(pyridin-2-yl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1ccccn1

STK575246
Synonyms: (5Z)-5-[5-nitro-2-(pyrrolidin-1-yl)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: O=C1NC(=S)S/C/1=C\c1cc(ccc1N1CCCC1)[N+](=O)[O-]

STK575248
Synonyms: methyl3-[(ethylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NS(=O)(=O)CC)cc(cc2)F

STK575249
Synonyms: N-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-(morpholin-4-yl)acetamide
Smiles: CCc1n[nH]/c(=N\C(=O)CN2CCOCC2)/s1

STK575250
Synonyms: (1-{2-[(4-ethoxyphenyl)amino]-2-oxoethyl}piperidinium-4-yl)(diphenyl)methanolate
Smiles: CCOc1ccc(cc1)NC(=O)C[NH+]1CCC(CC1)C(c1ccccc1)(c1ccccc1)[O-]

STK575251
Synonyms: 4,5,6-trimethoxy-N-(tetrahydrofuran-2-ylmethyl)-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)NCC1CCCO1

STK575253
Synonyms: 2-[(2E)-(2,3,4-trimethoxybenzylidene)hydrazinylidene]-2,3-dihydro-1H-benzimidazole
Smiles: COc1c(ccc(c1OC)OC)/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK848374
Synonyms: (3-methyl-6,7-dihydro-5H-spiro[1-benzofuran-4,2'-[1,3]dithiolan]-2-yl)(morpholin-4-yl)methanone
Smiles: O=C(c1oc2c(c1C)C1(CCC2)SCCS1)N1CCOCC1

STK575254
Synonyms: (2E)-2-(4-hydroxyquinazolin-2-yl)-3-[5-(piperidin-1-yl)furan-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(o1)N1CCCCC1)/c1nc(O)c2c(n1)cccc2

STK575259
Synonyms: 3-(2-chlorophenyl)-2,6-dihydroxy-5-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)pyrimidin-4(3H)-one
Smiles: O=C1OC(c2c1cccc2)c1c(O)nc(n(c1=O)c1ccccc1Cl)O

STK575263
Synonyms: 2-{[4-amino-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK848377
Synonyms: 6-chloro-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)ccc(c3)Cl)/s1

STK575266
Synonyms: 2-benzyl-8-(4-chlorophenyl)-11-(furan-2-yl)-10-methyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccc(cc1)n1nc(c2c1Oc1ncn3c(c1C2c1ccco1)nc(n3)Cc1ccccc1)C

STK848378
Synonyms: 2-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2,3-dihydro-1H-isoindol-1-imine
Smiles: N=C1N(Cc2c1cccc2)c1ccc(cc1)c1nnc2n1CCCCC2

STK848379
Synonyms: 4,7,7-trimethyl-2,3-dioxo-N-(pyridin-4-yl)bicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)Nc1ccncc1

STK575273
Synonyms: 11-methyl-N-(pyridin-3-ylmethyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: O=C(c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2)NCc1cccnc1

STK575279
Synonyms: 4-(3-phenoxyphenyl)-4,10-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: NC1=NC(n2c(=N1)[nH]c1c2cccc1)c1cccc(c1)Oc1ccccc1

STK575281
Synonyms: 5-[(2-chloro-4-fluorobenzyl)oxy]-2-[4-(4-chlorophenyl)-1H-pyrazol-5-yl]phenol
Smiles: Clc1ccc(cc1)c1cn[nH]c1c1ccc(cc1O)OCc1ccc(cc1Cl)F

STK575283
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-2-[(5Z)-5-(2-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: CCN(C1CCS(=O)(=O)C1)C(=O)CN1C(=S)S/C(=C\c2ccccc2F)/C1=O

STK848380
Synonyms: 1,7-dimethyl-4-oxo-N-(tetrahydrofuran-2-ylmethyl)-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)n(c(c1)C(=O)NCC1CCCO1)C

STK575285
Synonyms: 5-methyl-3-(4-methylphenyl)-7-[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine
Smiles: CC(=C)CN1CCN(CC1)c1cc(C)nc2n1ncc2c1ccc(cc1)C

STK575287
Synonyms: 3-amino-1-(4-methylphenyl)-1H-[1,3,5]triazino[1,2-a]quinazolin-6-ol
Smiles: Cc1ccc(cc1)C1N=C(N)N=c2n1c1ccccc1c(n2)O

STK575291
Synonyms: N-[(2E)-3-(2-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)/N=C\1/SC2C(N1c1ccccc1Cl)CS(=O)(=O)C2

STK848381
Synonyms: 8-(2,4-dimethoxyphenyl)-3-(4-ethylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: CCc1ccc(cc1)N1CSC2=C(C#N)C(CC(=O)N2C1)c1ccc(cc1OC)OC

STK575297
Synonyms: N-[(2-fluorobenzyl)carbamoyl]-L-phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)NCc1ccccc1F

STK575305
Synonyms: (3aS,4R,4aS,7aR,8R,8aS)-6-(4-chlorophenyl)-3-[(E)-2-phenylethenyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-epoxy[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1O[C@H]2[C@H]2[C@@H]1ON=C2/C=C/c1ccccc1

STK575311
Synonyms: 2-[(2-methoxyphenoxy)methyl]-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1OCc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK848384
Synonyms: 2-methyl-3-phenyl-5-(propan-2-yl)-7-(pyrrolidin-1-yl)pyrazolo[1,5-a]pyrimidine
Smiles: Cc1nn2c(c1c1ccccc1)nc(cc2N1CCCC1)C(C)C

STK575314
Synonyms: 2-(2,4-dichlorophenoxy)-1-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)C(Oc1ccc(cc1Cl)Cl)C

STK575315
Synonyms: (3aR,6aS)-3-(2,3-dimethoxyphenyl)-5-(4-fluorophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1cccc(c1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)F

STK848385
Synonyms: (2Z)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(2,5-dimethoxyphenyl)imino]-4-hydroxy-5,6-dihydro-2H-1,3-thiazine-6-carboxamide
Smiles: COc1ccc(c(c1)/N=C\1/N=C(O)CC(S1)C(=O)Nc1cc(ccc1Cl)C(F)(F)F)OC

STK575324
Synonyms: (4-ethylpiperazin-1-yl)(6-methoxy-1H-indol-2-yl)methanone
Smiles: CCN1CCN(CC1)C(=O)c1cc2c([nH]1)cc(cc2)OC

STK575325
Synonyms: N-(3-hydroxypropyl)-2-[(6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]acetamide
Smiles: OCCCNC(=O)COc1ccc2c(c1)oc(=O)c1c2CCCC1

STK575328
Synonyms: (3S)-N-{(2S)-1-[(4-methylbenzyl)amino]-1-oxopropan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C)NCc1ccc(cc1)C

STK575331
Synonyms: 6,7-dichloro-3-{[2-(diethylamino)ethoxy]carbonyl}-4-[(dimethylammonio)methyl]-2-methyl-1-benzofuran-5-olate
Smiles: CCN(CCOC(=O)c1c(C)oc2c1c(C[NH+](C)C)c([O-])c(c2Cl)Cl)CC

STK575333
Synonyms: 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea
Smiles: O=C(Nc1ccccc1)Nc1ccc2c(c1)nc(n2C)CCN1CCCCCC1

STK575335
Synonyms: 2-[(5Z)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[3-(1H-imidazol-1-yl)propyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2)/C1=O)NCCCn1cncc1

STK848388
Synonyms: (4E)-4-[hydroxy(phenyl)methylidene]-5-phenyl-1-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: O/C(=C/1\C(c2ccccc2)N(C(=O)C1=O)c1cccnc1)/c1ccccc1

STK848390
Synonyms: 2-(3-hydroxypropyl)-1'-(prop-2-en-1-yl)-2H-spiro[chromeno[2,3-c]pyrrole-1,3'-indole]-2',3,9(1'H)-trione
Smiles: OCCCN1C(=O)c2c(C31C(=O)N(c1c3cccc1)CC=C)c(=O)c1c(o2)cccc1

STK575339
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COc1cccc(c1)Nc1cc(nc2n1ncc2c1ccc(cc1)Cl)C(C)(C)C

STK575342
Synonyms: 1-tert-butyl4-(8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl)piperidine-1,4-dicarboxylate
Smiles: COc1ccc2c(c1)c(=O)oc1c2ccc(c1)OC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK575343
Synonyms: 8-{[(Z)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]amino}-2',6'-dihydroxy-3-phenyl-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-4'-one
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(N/C=C\3/C(=NC(=NC3=O)O)O)ccc1N1C2CN(CC1)c1ccccc1

STK575352
Synonyms: 2-[(6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-4-ylmethyl)acetamide
Smiles: CCc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)NCc1ccncc1

STK575355
Synonyms: 2-[(5E)-5-(3,4-dihydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoicacid
Smiles: CCC(N1C(=S)S/C(=C/c2ccc(c(c2)O)O)/C1=O)C(=O)O

STK575356
Synonyms: 5-[(4-ethoxybenzyl)amino]-2-(morpholin-4-ium-4-yl)benzoate
Smiles: CCOc1ccc(cc1)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK575358
Synonyms: 2,6-diamino-4-[4-(propan-2-yloxy)phenyl]-4H-thiopyran-3,5-dicarbonitrile
Smiles: CC(Oc1ccc(cc1)C1C(=C(N)SC(=C1C#N)N)C#N)C

STK575360
Synonyms: 4-{[(2Z)-3-(3,5-dimethylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)/N=C/1\SC2C(N1c1cc(C)cc(c1)C)CS(=O)(=O)C2

STK848393
Synonyms: 2-bromopyrido[1,2-b][2,4]benzodiazepin-6(11H)-imine
Smiles: Brc1ccc2=NC(=N)c3c(Cn2c1)cccc3

STK575364
Synonyms: N-(3-acetylphenyl)-2-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: CCC(n1cnc2c(c1=O)cccc2)C(=O)Nc1cccc(c1)C(=O)C

STK575365
Synonyms: 5-tert-butyl-7-(4-cyclohexylpiperazin-1-yl)-3-phenylpyrazolo[1,5-a]pyrimidine
Smiles: CC(c1cc(N2CCN(CC2)C2CCCCC2)n2c(n1)c(cn2)c1ccccc1)(C)C

STK575367
Synonyms: 5-[(2E)-3-(4-chlorophenyl)prop-2-enoyl]-2,6-dihydroxy-3-(prop-2-en-1-yl)pyrimidin-4(3H)-one
Smiles: C=CCn1c(O)nc(c(c1=O)C(=O)/C=C/c1ccc(cc1)Cl)O

STK575368
Synonyms: 7-chloro-1-(4-fluorophenyl)-6-methyl-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK575369
Synonyms: 7-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)-2-(prop-2-en-1-ylsulfanyl)-5,6-dihydropyrido[2,3-d]pyrimidin-4(3H)-one
Smiles: C=CCSc1nc2N=C(O)CC(c2c(=O)[nH]1)c1cc(OC)c(c(c1)OC)O

STK575370
Synonyms: 5-(2-hydroxy-3,4-dimethylphenyl)-N-(4-methoxybenzyl)-1H-pyrazole-3-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1n[nH]c(c1)c1ccc(c(c1O)C)C

STK575374
Synonyms: 2-[(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)amino]ethanol
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCCO

STK575375
Synonyms: 8-(2-aminophenyl)-4-hydroxy-1,6,7-trimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Nc1ccccc1n1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK575379
Synonyms: 5-(2-hydroxy-3,5-dimethylphenyl)-N-(4-methoxybenzyl)-1H-pyrazole-3-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1n[nH]c(c1)c1cc(C)cc(c1O)C

STK848396
Synonyms: 6-ethyl-2-{[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl}-4H-chromen-4-one
Smiles: CCc1ccc2c(c1)c(=O)cc(o2)C(=O)N1CCN(CC1)c1ccc(cc1)OC

STK575381
Synonyms: 5-[(2-fluorobenzyl)oxy]-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol
Smiles: Oc1cc(ccc1c1onc(c1c1ccccc1)C)OCc1ccccc1F

STK848397
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Cc1cccc(c1)n1ccc(=O)c(n1)C(=O)Nc1ccc(c(c1)C(F)(F)F)Cl

STK848398
Synonyms: (4E)-5-(2,4-dimethoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-phenylpyrrolidine-2,3-dione
Smiles: COc1ccc(c(c1)OC)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccccc1

STK575387
Synonyms: 2-[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-4-ylmethyl)acetamide
Smiles: O=C(NCc1ccncc1)COc1ccc2c(c1)oc(=O)c(c2C)C

STK575389
Synonyms: (5Z)-3-{2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoethyl}-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: OCCC1CCCCN1C(=O)CN1C(=S)S/C(=C\c2cccs2)/C1=O

STK848399
Synonyms: 7-[(3-chlorobenzyl)oxy]-3-(3,4-dimethoxyphenyl)-4H-chromen-4-one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc(c2)OCc1cccc(c1)Cl

STK848400
Synonyms: 5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1H-pyrazol-5-yl]phenol
Smiles: COc1ccc(cc1)c1c(C)n[nH]c1c1ccc(cc1O)OC

STK575391
Synonyms: 3-(2-hydroxy-3,5-dimethylphenyl)-4-(3-hydroxyphenyl)-5-(3-methoxypropyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COCCCN1C(=O)c2c(C1c1cccc(c1)O)c([nH]n2)c1cc(C)cc(c1O)C

STK575397
Synonyms: N-[3-({2-[4-(propan-2-yloxy)phenyl]quinazolin-4-yl}oxy)phenyl]acetamide
Smiles: CC(=O)Nc1cccc(c1)Oc1nc(nc2c1cccc2)c1ccc(cc1)OC(C)C

STK575403
Synonyms: 2-(1,3-benzoxazol-2-ylamino)-4-(3-methoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5-ol
Smiles: COc1cccc(c1)C1N=C(Nc2nc3c(o2)cccc3)N=C2C1=C(O)CC(C2)(C)C

STK848403
Synonyms: 4-(2-fluorophenyl)-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1c1ccccc1F

STK575408
Synonyms: 8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(CN2CC(C)CC(C2)C)nc2c1c(=O)n(c(=O)n2C)C

STK848404
Synonyms: (6E)-7-imino-2-methyl-6-[(5-phenylfuran-2-yl)methylidene]-6,7-dihydro-5H-[1,2]oxazolo[2,3-a]pyrimidin-5-one
Smiles: Cc1on2c(=NC(=O)/C(=C/c3ccc(o3)c3ccccc3)/C2=N)c1

STK575409
Synonyms: 2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)COc1cc(C)cc2c1c1CCCc1c(=O)o2

STK575413
Synonyms: 7-chloro-1-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cc(ccc1O)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK575414
Synonyms: 9-(4-ethylpiperazin-1-yl)-2-methyl-3-phenyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline
Smiles: CCN1CCN(CC1)c1c2CCCCc2nc2n1nc(c2c1ccccc1)C

STK575417
Synonyms: 5-(4-chlorophenyl)-3-[2-(diethylamino)ethyl]-4-imino-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: CCN(CCn1cnc2c(c1=N)C(c1ccc(cc1)Cl)c1c(O2)cc(cc1)O)CC

STK575418
Synonyms: 5,6-dimethyl-N-[3-(trifluoromethyl)phenyl]furo[2,3-d]pyrimidin-4-amine
Smiles: Cc1oc2c(c1C)c(ncn2)Nc1cccc(c1)C(F)(F)F

STK575422
Synonyms: 1-(3-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Oc1cccc(c1)C1NC(=O)c2c1c(=O)c1c(o2)cccc1

STK575424
Synonyms: (5Z)-5-(2,3-dimethoxybenzylidene)-2-imino-2,5-dihydro-1,3-thiazol-4-ol
Smiles: COc1c(/C=C/2\SC(=N)N=C2O)cccc1OC

STK575426
Synonyms: 7-(furan-2-yl)-2-hydroxy-N-(4-methylphenyl)-5-oxo-3,4,5,6,7,8-hexahydroquinoline-4-carboxamide
Smiles: OC1=NC2=C(C(C1)C(=O)Nc1ccc(cc1)C)C(=O)CC(C2)c1ccco1

STK575427
Synonyms: (E)-1-(2-methoxyphenyl)-N-(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-ylmethoxy)methanimine
Smiles: COc1ccccc1/C=N/OCc1nc2n(n1)cnc1c2c2CCCCCc2s1

STK575432
Synonyms: 7-(2-chloro-6-fluorobenzyl)-6-hydroxy-3-methyl-8-[(4-methylpiperazin-1-yl)methyl]-3,7-dihydro-2H-purin-2-one
Smiles: CN1CCN(CC1)Cc1nc2c(n1Cc1c(F)cccc1Cl)c(O)nc(=O)n2C

STK575436
Synonyms: 2-[4-(4-chlorophenyl)-3-methyl-1,2-oxazol-5-yl]-5-[(4-nitrobenzyl)oxy]phenol
Smiles: Clc1ccc(cc1)c1c(C)noc1c1ccc(cc1O)OCc1ccc(cc1)[N+](=O)[O-]

STK575437
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)c1cc2c(n1C)ccc(c2)Cl)C

STK848409
Synonyms: 2-ethyl-N-[2-(morpholin-4-yl)ethyl][1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: CCc1nc(NCCN2CCOCC2)c2c(n1)c1ccccc1o2

STK575442
Synonyms: N,N-dimethyl-N'-(2-methyl-3,5-diphenylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
Smiles: CN(CCNc1cc(nc2n1nc(c2c1ccccc1)C)c1ccccc1)C

STK575445
Synonyms: 9-hydroxy-7-(morpholin-4-yl)-6,8-diazaspiro[4.5]deca-6,8-diene-10-carbonitrile
Smiles: N#CC1C(=NC(=NC21CCCC2)N1CCOCC1)O

STK575458
Synonyms: 8-(ethylsulfanyl)-6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CCSc1nc2c(n1CC(=C)C)c(O)nc(=O)n2C

STK575466
Synonyms: 2-[2-amino-5-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-[(4-methylbenzyl)oxy]phenol
Smiles: Nc1nc(c2ccc(cc2O)OCc2ccc(cc2)C)c(c(n1)C(F)(F)F)c1ccc(cc1)Cl

STK575467
Synonyms: N-(3-methyl-1-oxo-1-{[3-(1H-tetrazol-1-yl)phenyl]amino}butan-2-yl)benzamide
Smiles: CC(C(C(=O)Nc1cccc(c1)n1cnnn1)NC(=O)c1ccccc1)C

STK575469
Synonyms: 1-{3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanoyl}piperidine-4-carboxylicacid
Smiles: O=C(N1CCC(CC1)C(=O)O)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK575470
Synonyms: 6-ethyl-6-methyl-2-(methylsulfanyl)-4-(piperidin-1-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(nc1N1CCCCC1)SC

STK848413
Synonyms: 5-methoxy-2-[5-(2-methoxyphenyl)pyrimidin-4-yl]phenol
Smiles: COc1ccc(c(c1)O)c1ncncc1c1ccccc1OC

STK575471
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(2-fluorophenyl)-5-[2-(4-methoxyphenyl)ethyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccccc1F)c([nH]n2)c1cc(Cl)c(cc1O)C

STK575472
Synonyms: 2-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)NCCc1ccc(cc1)S(=O)(=O)N

STK575477
Synonyms: 3-[(2E)-2-(5-cyano-6-hydroxy-4-methyl-2-oxopyridin-3(2H)-ylidene)hydrazinyl]benzoicacid
Smiles: N#CC1=C(C)/C(=N\Nc2cccc(c2)C(=O)O)/C(=O)N=C1O

STK848414
Synonyms: 1-(1H-imidazol-1-yl)-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCc1cc(n2cncc2)n2c(c1C#N)nc1c2cccc1

STK575479
Synonyms: 5-[(2,5-dimethylbenzyl)oxy]-2-[4-(3-methoxyphenoxy)-3-methyl-1H-pyrazol-5-yl]phenol
Smiles: COc1cccc(c1)Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1cc(C)ccc1C

STK575481
Synonyms: 6-[2-(azepan-1-yl)-2-oxoethyl]-9-fluoro-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one
Smiles: Fc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2CC(=O)N1CCCCCC1

STK575482
Synonyms: 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(4-sulfamoylbenzyl)propanamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NCc1ccc(cc1)S(=O)(=O)N

STK575484
Synonyms: 5-(4-chlorophenyl)-4-imino-3-(2-methylpropyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: Clc1ccc(cc1)C1c2ccc(cc2Oc2c1c(=N)n(cn2)CC(C)C)O

STK575486
Synonyms: N-(2,5-dimethoxyphenyl)-5-(2-hydroxy-4-methylphenyl)-1H-pyrazole-3-carboxamide
Smiles: COc1ccc(cc1NC(=O)c1n[nH]c(c1)c1ccc(cc1O)C)OC

STK575491
Synonyms: 2-[2-amino-5-(4-methoxyphenyl)pyrimidin-4-yl]-5-[(2,6-dichlorobenzyl)oxy]phenol
Smiles: COc1ccc(cc1)c1cnc(nc1c1ccc(cc1O)OCc1c(Cl)cccc1Cl)N

STK575493
Synonyms: methylN-[(5-hydroxypentyl)carbamoyl]-D-alaninate
Smiles: C[C@H](C(=O)OC)NC(=O)NCCCCCO

STK575495
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(naphthalen-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK848415
Synonyms: 3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-7,8,9,10-tetrahydropyrimido[4',5':4,5]furo[2,3-b]quinolin-4(3H)-one
Smiles: O=C(N1CCCC1)Cn1cnc2c(c1=O)oc1c2cc2c(n1)CCCC2

STK575498
Synonyms:
Smiles: CCC([C@@H](c1nnc(o1)SCC(=O)Nc1ccccc1CC)N)C

STK575501
Synonyms: N-{[2-(4-chlorophenyl)ethyl]carbamoyl}-L-alanine
Smiles: C[C@@H](C(=O)O)NC(=O)NCCc1ccc(cc1)Cl

STK575503
Synonyms: (3R)-2,2-dimethyl-5-oxo-N-[(2S)-1-oxo-1-(pentylamino)propan-2-yl]-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: CCCCCNC(=O)[C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C

STK575504
Synonyms: 1-ethyl-1',2,3',10-tetramethyl-2H,2'H,4H-spiro[dipyrido[1,2-a:2',3'-d]pyrimidine-3,5'-pyrimidine]-2',4',5,6'(1H,1'H,3'H)-tetrone
Smiles: CCN1c2nc3c(C)cccn3c(=O)c2CC2(C1C)C(=O)N(C)C(=O)N(C2=O)C

STK575505
Synonyms: 5-[(2-ethoxy-3-methoxybenzyl)amino]-2-(morpholin-4-ium-4-yl)benzoate
Smiles: CCOc1c(cccc1OC)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK575521
Synonyms: 3-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide
Smiles: OCC(Cc1ccccc1)NC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)F)/C1=O

STK848421
Synonyms: 3-(2-methoxyphenyl)-5-methyl-7-(morpholin-4-yl)pyrazolo[1,5-a]pyrimidine
Smiles: COc1ccccc1c1cnn2c1nc(C)cc2N1CCOCC1

STK575522
Synonyms: 5-benzyl-4,6-dihydroxy-1-(2-methylphenyl)pyrimidin-2(1H)-one
Smiles: Cc1ccccc1n1c(=O)nc(c(c1O)Cc1ccccc1)O

STK575524
Synonyms: 1-[bis(2-methoxyethyl)amino]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: COCCN(c1cc(C)c(c2n1c1ccccc1n2)C#N)CCOC

STK575526
Synonyms: N-(5-benzyl-1,3-thiazol-2-yl)-3-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanamide
Smiles: O=C(Nc1ncc(s1)Cc1ccccc1)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK848423
Synonyms: 2-(2-fluorophenoxy)-N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]butanamide
Smiles: CCC(C(=O)Nc1nonc1c1ccc(cc1)C)Oc1ccccc1F

STK575527
Synonyms: 1-hydroxyisoquinolin-5-ylbenzoate
Smiles: O=C(c1ccccc1)Oc1cccc2c1ccnc2O

STK848424
Synonyms: N-(4-butylphenyl)-1-(3-methoxypropyl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: CCCCc1ccc(cc1)NC(=O)c1cc2c(n1CCCOC)nc1n(c2=O)cccc1C

STK575531
Synonyms: 4-[(2-methylpiperidin-1-yl)methyl]-7,8-dihydrocyclopenta[g]chromen-2(6H)-one
Smiles: CC1CCCCN1Cc1cc(=O)oc2c1cc1CCCc1c2

STK575532
Synonyms: 2-[2-amino-5-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-[(4-ethenylbenzyl)oxy]phenol
Smiles: COc1ccc(cc1)c1c(nc(nc1C(F)(F)F)N)c1ccc(cc1O)OCc1ccc(cc1)C=C

STK575534
Synonyms: 6-ethyl-2-oxo-4-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-ium-1-yl}methyl)-2H-chromen-7-olate
Smiles: CCc1cc2c(cc1[O-])oc(=O)cc2C[NH+]1CCN(CC1)C/C=C/c1ccccc1

STK848426
Synonyms: 1,7-dimethyl-N-(2-methylpropyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: CC(CNC(=O)c1cc2c(n1C)nc1n(c2=O)cc(cc1)C)C

STK575538
Synonyms: N-benzyl-2-(6-hydroxy-3-methyl-2-oxo-2,3-dihydro-7H-purin-7-yl)acetamide
Smiles: O=C(Cn1cnc2c1c(O)nc(=O)n2C)NCc1ccccc1

STK848427
Synonyms: N-(3,4-dimethylphenyl)-N'-{[4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl]methyl}ethanediamide
Smiles: COc1ccc(cc1)C1(CCOCC1)CNC(=O)C(=O)Nc1ccc(c(c1)C)C

STK575539
Synonyms: N,N-diethyl-4-(2-imino-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-3(2H)-yl)-3-methylaniline
Smiles: CCN(c1ccc(c(c1)C)N1C(=N)SC2C1CS(=O)(=O)C2)CC

STK575540
Synonyms: (5Z)-5-(furan-2-ylmethylidene)-3-{2-oxo-2-[2-(pyridin-3-yl)piperidin-1-yl]ethyl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2ccco2)/C(=O)N1CC(=O)N1CCCCC1c1cccnc1

STK575545
Synonyms: 6-hydroxy-8-(4-methoxyphenyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COc1ccc(cc1)c1[nH]c2c(n1)n(C)c(=O)nc2O

STK575551
Synonyms: 7,9-di(thiophen-2-yl)thieno[2,3-b:4,5-b']dipyridine-2,4-diol
Smiles: Oc1cc(O)c2c(n1)c1c(s2)nc(cc1c1cccs1)c1cccs1

STK575553
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-7-(4-methylpiperidin-1-yl)pyrazolo[1,5-a]pyrimidine
Smiles: CC1CCN(CC1)c1cc(nc2n1ncc2c1ccc(cc1)Cl)C(C)(C)C

STK848429
Synonyms: 4-(2-fluorophenyl)-3-(2-hydroxyphenyl)-5-(3-methoxypropyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COCCCN1C(=O)c2c(C1c1ccccc1F)c([nH]n2)c1ccccc1O

STK575554
Synonyms: 2'-hydroxy-1',3-dimethyl-8-nitro-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)C)O

STK575556
Synonyms: 6-chloro-4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-2H-chromen-2-one
Smiles: Clc1cccc(c1)N1CCN(CC1)Cc1cc(=O)oc2c1cc(Cl)cc2

STK575558
Synonyms: 9-[5-(2-chlorophenyl)furan-2-yl]-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccc(o1)c1ccccc1Cl)n1c(N2)ncn1

STK848431
Synonyms: N-[4-(4-methoxyphenyl)-1,2,5-oxadiazol-3-yl]butanamide
Smiles: CCCC(=O)Nc1nonc1c1ccc(cc1)OC

STK575561
Synonyms: 5,5-diethyl-2-(morpholin-4-ylmethyl)-5,6-dihydrobenzo[h]quinazolin-4-ol
Smiles: CCC1(CC)Cc2ccccc2c2c1c(O)nc(n2)CN1CCOCC1

STK575562
Synonyms: (3a'S,6a'R)-5'-(butan-2-yl)-3'-(4-hydroxybenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cccc2)C

STK575563
Synonyms: 4-hydroxy-3,6,6-trimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: O=C(c1oc2c(c1C)C(O)CC(C2)(C)C)NC1CC(C)(C)NC(C1)(C)C

STK575564
Synonyms: 3-(2-hydroxy-3,5-dimethylphenyl)-5-[2-(4-methoxyphenyl)ethyl]-4-[4-(propan-2-yl)phenyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(cc1)C(C)C)c([nH]n2)c1cc(C)cc(c1O)C

STK848432
Synonyms: 2-{4-[5-methyl-3-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1cc(C)nc2n1nc(c2c1ccccc1)C(F)(F)F

STK575566
Synonyms: S-benzyl-N-[(6'-methyl-8'-oxo-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-7'-yl)acetyl]-L-cysteine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2)N[C@H](C(=O)O)CSCc1ccccc1

STK575567
Synonyms: 11-(2-methoxyphenyl)-10-methyl-8-phenyl-2-(pyridin-3-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1cccnc1)c1ccccc1

STK575571
Synonyms: 3-[(4-chlorophenyl)sulfonyl]-1-(3-ethoxypropyl)-2-imino-8-methyl-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Smiles: CCOCCCn1c2nc3ccc(cn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccc(cc1)Cl)C

STK575576
Synonyms: 6-{[(4-chlorophenyl)sulfanyl]methyl}-2-(morpholin-4-yl)pyrimidin-4-ol
Smiles: Clc1ccc(cc1)SCc1cc(O)nc(n1)N1CCOCC1

STK575580
Synonyms: ethyl3-{[(5-chlorothiophen-2-yl)sulfonyl]amino}-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NS(=O)(=O)c1ccc(s1)Cl)cc(cc2)OC

STK575582
Synonyms: 7'-{(E)-[1-(butan-2-yl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CCC(N1C(=NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)S)C

STK575588
Synonyms: N-[(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]-S-methyl-L-cysteine
Smiles: CSC[C@@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)O

STK575589
Synonyms: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-(2-hydroxy-4,5-dimethylphenyl)-1H-pyrazole-3-carboxamide
Smiles: O=C(c1n[nH]c(c1)c1cc(C)c(cc1O)C)Nc1ccc(cc1)S(=O)(=O)N1CCCCCC1

STK848434
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-2,8,10-trimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-4-amine
Smiles: COc1cc(CCNc2cc(C)nc3n2nc2c3c(C)cc(n2)C)ccc1OC

STK575595
Synonyms: 2-{1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]cyclohexyl}-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylicacid
Smiles: OC(=O)C1C2C=CC3(C1C(=O)N(C3)C1(CCCCC1)c1nnnn1c1c(C)cccc1C)O2

STK575596
Synonyms: (5E)-3-cyclohexyl-6-hydroxy-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/c1cc2CCCN3c2c(c1)CCC3)C1CCCCC1

STK575597
Synonyms: 8-(2-methoxy-5-methylphenyl)-1,3,6,7-tetramethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)C)C

STK848435
Synonyms: {[3-(4-bromophenyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl]oxy}acetonitrile
Smiles: N#CCOc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Br)C(F)(F)F

STK848436
Synonyms: 2-[5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-5-[(2-fluorobenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cncnc1c1ccc(cc1O)OCc1ccccc1F

STK575605
Synonyms: 3-[3-(1H-imidazol-1-yl)propyl]-8-methoxy-5-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1n2C)CCCn1cncc1

STK575609
Synonyms: 7-(4-bromophenyl)-5-phenyl-3,7-dihydrotetrazolo[1,5-a]pyrimidine
Smiles: Brc1ccc(cc1)C1C=C(N=c2n1nn[nH]2)c1ccccc1

STK575613
Synonyms: 2-(2-chlorophenyl)-9-methyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1ccccc1Cl

STK575614
Synonyms: 4-({[(5Z)-5-(4-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}amino)-2-hydroxybenzoicacid
Smiles: O=C(CN1C(=S)S/C(=C\c2ccc(cc2)Cl)/C1=O)Nc1ccc(c(c1)O)C(=O)O

STK575615
Synonyms: N-benzyl-5-(2-hydroxy-3,4-dimethylphenyl)-1H-pyrazole-3-carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1O)C)C)NCc1ccccc1

STK575616
Synonyms: N-[3-(1H-indol-3-yl)propanoyl]serine
Smiles: OCC(C(=O)O)NC(=O)CCc1c[nH]c2c1cccc2

STK575617
Synonyms: 4-(4-ethylphenyl)-3-(2-hydroxy-3,5-dimethylphenyl)-5-(pyridin-3-ylmethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: CCc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C

STK575619
Synonyms: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(5-chloro-2-hydroxy-4-methylphenyl)-5-(3-hydroxypropyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCCN1C(=O)c2c(C1c1cc(Br)c(c(c1)OC)O)c([nH]n2)c1cc(Cl)c(cc1O)C

STK848437
Synonyms: N-(1,3-benzodioxol-5-yl)-1-benzyl-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: O=C(c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C)Nc1ccc2c(c1)OCO2

STK575623
Synonyms: 1-benzyl-9-methyl-4-oxo-N-propyl-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: CCCNC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C

STK575624
Synonyms: 4-tert-butyl-N-[(2Z)-5-[(4-chlorobenzyl)sulfonyl]-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: Clc1ccc(cc1)CS(=O)(=O)c1n[nH]/c(=N/C(=O)c2ccc(cc2)C(C)(C)C)/s1

STK575627
Synonyms: 5-(5-chloro-2-hydroxyphenyl)-N-(4-methoxybenzyl)-1H-pyrazole-3-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1n[nH]c(c1)c1cc(Cl)ccc1O

STK575628
Synonyms: 2-[(4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-2-ylmethyl)acetamide
Smiles: CCc1cc(=O)oc2c1ccc(c2C)OCC(=O)NCc1ccccn1

STK575630
Synonyms: N-(furan-2-ylmethyl)-5,6-dimethoxy-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)NCc1ccco1

STK575634
Synonyms: 5-{(2E)-3-[4-(diethylamino)phenyl]prop-2-enoyl}-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Smiles: CCN(c1ccc(cc1)/C=C/C(=O)c1c(O)n(C)c(=O)n(c1=O)C)CC

STK575635
Synonyms: 7-(4-chlorophenyl)-2-(thiophen-2-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Clc1ccc(cc1)n1ncc2c1ncn1c2nc(n1)c1cccs1

STK575637
Synonyms: N-(2-chlorobenzyl)-1,7-dimethyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)n(c(c1)C(=O)NCc1ccccc1Cl)C

STK575639
Synonyms: 4-(3,5-dimethyl-1H-pyrazol-1-yl)-2,8,10-trimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine
Smiles: Cc1cc(C)c2c(n1)nn1c2nc(cc1n1nc(cc1C)C)C

STK848443
Synonyms: N-benzyl-6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-amine
Smiles: CCc1sc2c(c1)c(NCc1ccccc1)nc(n2)C

STK575648
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-5-(2-hydroxyethyl)-4-(3-methoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)OC)c([nH]n2)c1cc(Cl)c(cc1O)C

STK575651
Synonyms: 4-{[(2,4-dioxo-1,3-thiazolidin-5-yl)acetyl]amino}-2-hydroxybenzoicacid
Smiles: O=C(CC1SC(=O)NC1=O)Nc1ccc(c(c1)O)C(=O)O

STK575652
Synonyms: (3Z)-1-(2,6-dichlorophenyl)-3-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)propan-2-one
Smiles: COc1cc2/C(=C/C(=O)Cc3c(Cl)cccc3Cl)/NCCc2cc1OC

STK575654
Synonyms: (3R)-2,2-dimethyl-5-oxo-N-[(2S)-1-oxo-1-(piperidin-1-yl)propan-2-yl]-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C)N1CCCCC1

STK848447
Synonyms: N-benzyl-3-(2-methoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COc1ccccc1c1cnn2c1nc(C)cc2NCc1ccccc1

STK575655
Synonyms: 2-[(3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]-N-(pyridin-4-ylmethyl)propanamide
Smiles: Cc1cc(OC(C(=O)NCc2ccncc2)C)c2c(c1)oc(=O)c(c2C)Cc1ccccc1

STK575660
Synonyms: 1-benzyl-N-(3-methylbutyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: CC(CCNC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1)C

STK575662
Synonyms: 7,8-dihydroxy-4-{[4-(2-methoxyphenyl)piperazin-1-yl]methyl}-2H-chromen-2-one
Smiles: COc1ccccc1N1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2O)O

STK848449
Synonyms: 5-tert-butyl-2-methyl-N-(4-methylphenyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Cc1ccc(cc1)Nc1cc(nc2n1nc(c2c1ccccc1)C)C(C)(C)C

STK575670
Synonyms: 2-(4-acetylphenyl)-4-(phenylcarbonyl)hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione
Smiles: O=C1N(c2ccc(cc2)C(=O)C)C(=O)C2C1C(N1C2CCC1)C(=O)c1ccccc1

STK575672
Synonyms: 2-chloro-3-[(E)-(1,3-dihydro-2H-benzimidazol-2-ylidenehydrazinylidene)methyl]quinoline
Smiles: Clc1nc2ccccc2cc1/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK575674
Synonyms: 4-{[(E)-(2,5-dimethoxyphenyl)methylidene]amino}-5-(4-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F)OC

STK575675
Synonyms: 6-hydroxy-3-methyl-7-(propan-2-yl)-8-(pyrrolidin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: Oc1nc(=O)n(c2c1n(C(C)C)c(n2)N1CCCC1)C

STK575677
Synonyms: methyl4-[(3-{4-[(2-chlorobenzyl)oxy]-2-hydroxyphenyl}-1H-pyrazol-4-yl)oxy]benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1c[nH]nc1c1ccc(cc1O)OCc1ccccc1Cl

STK575679
Synonyms: 4-(3-methoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol
Smiles: COc1cccc(c1)C1NC(=NC2=C1CCc1c2cccc1)S

STK575687
Synonyms: propan-2-ylN-[(1,9-dimethyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-2-yl)carbonyl]glycinate
Smiles: CC(OC(=O)CNC(=O)c1cc2c(n1C)nc1n(c2=O)cccc1C)C

STK575688
Synonyms: ethyl4-({7-[(2-chloro-6-fluorobenzyl)oxy]-4-oxo-4H-chromen-3-yl}oxy)benzoate
Smiles: CCOC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OCc1c(F)cccc1Cl

STK848452
Synonyms: 2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)-5-[(2-methylprop-2-en-1-yl)oxy]phenol
Smiles: CC(=C)COc1ccc(c(c1)O)c1onc(c1c1ccccc1)C

STK848453
Synonyms: 3-(2,4-dimethoxyphenyl)-8-(3-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: COc1ccc(c(c1)OC)N1CSC2=C(C#N)C(CC(=O)N2C1)c1cccc(c1)OC

STK575693
Synonyms: 2-[4-(2-bromophenoxy)-1H-pyrazol-5-yl]-5-[(2-fluorobenzyl)oxy]phenol
Smiles: Fc1ccccc1COc1ccc(c(c1)O)c1[nH]ncc1Oc1ccccc1Br

STK848454
Synonyms: 2-methyl-N-[(5Z)-4-oxo-5-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: S=C1S/C(=C/2\C(=O)Nc3c2cccc3)/C(=O)N1NC(=O)c1ccccc1C