FULL DB

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

STK594973
Synonyms: N-[(2Z)-5,5-dioxido-3-(2-phenylethyl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methoxyacetamide
Smiles: COCC(=O)/N=C/1\SC2C(N1CCc1ccccc1)CS(=O)(=O)C2

STK594974
Synonyms: N-(2-tert-butylphenyl)-2-{[4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C(C)(C)C)CSc1nnc(n1c1ccccc1)c1ccccn1

STK594977
Synonyms: 2-(3,4-dimethoxyphenyl)-10-methyl-8-phenyl-11-(pyridin-3-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2)Oc2c(C1c1cccnc1)c(C)nn2c1ccccc1

STK594979
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-(4-propoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK594982
Synonyms: 1-(4-hydroxyphenyl)-2-(6-methoxy-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)O)c(=O)c1c(o2)cccc1

STK594985
Synonyms: 5,7-dichloro-2-(5-methyl-1,2-oxazol-3-yl)-1-(3-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)c(Cl)cc(c1)Cl

STK594988
Synonyms: 4-(1,3-benzodioxol-5-yl)-5-(3-phenyl-1H-pyrazol-5-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1c1ccc2c(c1)OCO2)c1[nH]nc(c1)c1ccccc1

STK594989
Synonyms: ethyl(8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate
Smiles: CCOC(=O)Cn1c(CN2CCN(CC2)c2ccc(cc2)OC)nc2c1c(=O)n(c(=O)n2C)C

STK594990
Synonyms: (2E)-1-(6-bromo-2-hydroxy-4-phenylquinolin-3-yl)-3-(quinoxalin-6-yl)prop-2-en-1-one
Smiles: Brc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)C(=O)/C=C/c1ccc2c(c1)nccn2

STK594991
Synonyms: (3a'S,6a'R)-7-chloro-5'-(2-methoxyethyl)-3'-(2-methylpropyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1cccc2Cl

STK594992
Synonyms: 1-(4-ethoxy-3-methoxyphenyl)-7-fluoro-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK594993
Synonyms: 3-{[(E)-(2-fluorophenyl)methylidene]amino}-2-hydroxy-7-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)[nH]c1c2nc(n(c1=O)/N=C/c1ccccc1F)O

STK594994
Synonyms: 5,11-dimethyl-N-[2-(morpholin-4-yl)ethyl]-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(nc2C)sc2c1C(C)CCC2)NCCN1CCOCC1

STK594998
Synonyms: 2-[(2-fluorobenzyl)sulfanyl]-3-(4-methoxyphenyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COc1ccc(cc1)n1c(SCc2ccccc2F)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK594999
Synonyms: N-(3,5-dimethoxyphenyl)-2-({5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccc(cc2)C)COc2ccc(cc2)C)cc(c1)OC

STK595001
Synonyms: N-[(1-methyl-1H-benzimidazol-2-yl)methyl]-1,1-diphenylmethanamine
Smiles: Cn1c(CNC(c2ccccc2)c2ccccc2)nc2c1cccc2

STK595002
Synonyms: ethyl4-({(E)-[2-(3,4-dimethylphenyl)-1,3-dioxo-2,3-dihydroisoquinolin-4(1H)-ylidene]methyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(c(c1)C)C

STK595004
Synonyms: N-[1-ethyl-4-oxo-3-(thiophen-2-yl)-1,4-dihydroquinolin-2-yl]thiophene-2-carboxamide
Smiles: CCn1c(NC(=O)c2cccs2)c(c2cccs2)c(=O)c2c1cccc2

STK595005
Synonyms: 7-(propan-2-yl)-14H-thiochromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-14-one
Smiles: CC(c1nc2sc3ccccc3c(=O)c2c2n1c1ccccc1n2)C

STK595007
Synonyms: 4-[(4-oxoquinazolin-3(4H)-yl)methyl]-N-[3-(trifluoromethyl)phenyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1cnc2c(c1=O)cccc2)Nc1cccc(c1)C(F)(F)F

STK595008
Synonyms: 3-(4-chlorophenyl)-5-[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-2,6-dihydroxypyrimidin-4(3H)-one
Smiles: COc1cc(/C=C/C(=O)c2c(O)nc(n(c2=O)c2ccc(cc2)Cl)O)ccc1OC

STK595009
Synonyms: 2-(1,3-benzothiazol-2-yl)-1-(2,5-dimethoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(c(c1)C1N(c2nc3c(s2)cccc3)C(=O)c2c1c(=O)c1c(o2)cccc1)OC

STK595010
Synonyms: 3-(1H-benzimidazol-1-yl)-N-(pyridin-2-ylmethyl)propanamide
Smiles: O=C(CCn1cnc2c1cccc2)NCc1ccccn1

STK595011
Synonyms: (5E)-6-hydroxy-3-(4-methylphenyl)-5-[(2-phenyl-1H-indol-3-yl)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C\c2c([nH]c3c2cccc3)c2ccccc2)/C1=O)O

STK595012
Synonyms: N-(3-chlorophenyl)-2-({4-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccc(cc1)C

STK595013
Synonyms: 2-(2-chlorobenzyl)-1-(pyridin-4-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Clc1ccccc1CN1C(=O)c2c(C1c1ccncc1)c(=O)c1c(o2)cccc1

STK595015
Synonyms: 9-(4-chlorophenyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Smiles: Clc1ccc(cc1)N1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK595016
Synonyms: (2Z)-1-(8-bromo-2,3-dihydro-1,4-benzodioxin-6-yl)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)ethanone
Smiles: O=C(c1cc(Br)c2c(c1)OCCO2)/C=C/1\NCCc2c1cc1OCOc1c2

STK595019
Synonyms: (3a'S,6a'R)-7-chloro-5'-(2,3-dihydro-1,4-benzodioxin-6-yl)-3'-(1H-indol-3-ylmethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: O=C1N(c2ccc3c(c2)OCCO3)C(=O)[C@@H]2[C@H]1C(Cc1c[nH]c3c1cccc3)NC12C(=O)Nc2c1cccc2Cl

STK595020
Synonyms: 1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-yl6-{[(4-methylphenyl)sulfonyl]amino}hexanoate
Smiles: O=C(Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)CCCCCNS(=O)(=O)c1ccc(cc1)C

STK595022
Synonyms: 7-(furan-2-yl)-5-hydroxy-2-methyl-N-(pyridin-2-yl)-4-(thiophen-2-yl)-4,6,7,8-tetrahydroquinoline-3-carboxamide
Smiles: CC1=C(C(=O)Nc2ccccn2)C(C2=C(CC(CC2=N1)c1ccco1)O)c1cccs1

STK595023
Synonyms: 4-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium-1-yl]methyl}-7-methyl-2-oxo-2H-chromen-5-olate
Smiles: Cc1cc([O-])c2c(c1)oc(=O)cc2C[NH+]1CCN(CC1)Cc1ccc2c(c1)OCO2

STK595024
Synonyms: 2-(furan-2-yl)-3-hexyl-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: CCCCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccco1

STK595026
Synonyms: (1S)-1-[5-(ethylsulfanyl)-1,3,4-oxadiazol-2-yl]-3-methylbutan-1-amine
Smiles: CCSc1nnc(o1)[C@H](CC(C)C)N

STK595027
Synonyms: 4-(4-chlorophenyl)-3-[(4-methylbenzyl)sulfanyl]-5-(3-methylphenyl)-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)C

STK595028
Synonyms: ethyl[7-hydroxy-3-(2-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-5-yl]acetate
Smiles: CCOC(=O)Cc1cc(O)n2c(n1)c(c(n2)C)c1ccccc1OC

STK595029
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccc(c(c1)Cl)OC

STK595031
Synonyms: 1-{[5-(4-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3,3-dimethylbutan-2-one
Smiles: C=CCn1c(SCC(=O)C(C)(C)C)nnc1c1ccc(cc1)Cl

STK595032
Synonyms: (1'S,2'S,3R,3a'R)-2'-(1,3-benzodioxol-5-ylcarbonyl)-1'-(2,2-dimethylpropanoyl)-7'-methyl-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Cc1ccc2c(c1)C=C[C@H]1N2[C@H](C(=O)C(C)(C)C)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)OCO2

STK595033
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-(2-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)c1ccccc1

STK595035
Synonyms: N-[4-({(E)-[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}amino)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)F)S

STK595036
Synonyms: 5-{[(2Z)-3-(3-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)/N=C/1\SC2C(N1c1cccc(c1)Cl)CS(=O)(=O)C2

STK595037
Synonyms: 6-(3,4-dichlorophenyl)-2-methyl-7-(pyridin-3-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Cc1ccc2c(c1)C1=C(C(O2)c2ccc(c(c2)Cl)Cl)C(n2c(N1)ncn2)c1cccnc1

STK595038
Synonyms: N-(4-fluorobenzyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Smiles: O=C(CN1CCc2c(C1)cc1c(c2)OCCCO1)NCc1ccc(cc1)F

STK595039
Synonyms: 8-(3-methoxyphenyl)-1-methyl-3-(2-phenylethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: COc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK595042
Synonyms: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK595044
Synonyms: (4E)-4-{[(2-hydroxyphenyl)amino]methylidene}-2-(6-methylpyridin-2-yl)isoquinoline-1,3(2H,4H)-dione
Smiles: Cc1cccc(n1)N1C(=O)/C(=C/Nc2ccccc2O)/c2c(C1=O)cccc2

STK595045
Synonyms: 2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(2-methoxyethyl)acetamide
Smiles: COCCNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)F

STK595046
Synonyms: (5E)-6-hydroxy-3-(2-methylphenyl)-5-[1-(morpholin-4-ylamino)ethylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C(\NN2CCOCC2)/C)/C(=O)N1c1ccccc1C

STK595047
Synonyms: 8-(3-chlorophenyl)-1,7-dimethyl-3-[2-(piperidin-1-yl)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Clc1cccc(c1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK595048
Synonyms: 2-[(6-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]-N-(pyridin-4-ylmethyl)propanamide
Smiles: O=C(C(Oc1ccc2c(c1C)oc(=O)c1c2CCC1)C)NCc1ccncc1

STK595049
Synonyms: ethyl(8-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate
Smiles: CCOC(=O)Cn1c(CN2CCN(CC2)c2cc(Cl)ccc2C)nc2c1c(=O)n(c(=O)n2C)C

STK595050
Synonyms: 4-fluoro-N-(2-methylpropyl)-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: CC(CN(S(=O)(=O)c1ccc(cc1)F)Cc1cc2ccccc2[nH]c1=O)C

STK595051
Synonyms: (2'S,3S,3'S,10b'R)-2'-(1-benzofuran-2-ylcarbonyl)-3'-[(2-chlorophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Clc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cc4c(o1)cccc4)C(=O)Nc1c2cccc1)cccc3

STK595053
Synonyms: 5-cyclopropyl-N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2n[nH]c(c2)C2CC2)cc(c1OC)OC

STK595057
Synonyms: N'-{(Z)-[2-hydroxy-1-(4-methoxyphenyl)-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}heptanehydrazide
Smiles: CCCCCCC(=O)NN/C=C\1/C(=O)N=C(N(C1=O)c1ccc(cc1)OC)O

STK595058
Synonyms: (4-{(3aR,4R,4aR,7aS,8R,8aR)-5,7-dioxo-6-[3-(trifluoromethyl)phenyl]-4,4a,5,6,7,7a,8,8a-octahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindol-3-yl}phenoxy)acetonitrile
Smiles: N#CCOc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F

STK595059
Synonyms: (1'R,2'R)-1'-[(4-chlorophenyl)carbonyl]-2'-(4-methylphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Cc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

STK595060
Synonyms: 2-[(3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]-N-(2-methoxyethyl)propanamide
Smiles: COCCNC(=O)C(Oc1cc(C)cc2c1c(C)c(c(=O)o2)Cc1ccccc1)C

STK595061
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(2-bromophenyl)-7-ethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Br

STK595062
Synonyms: 9-methyl-2-[4-(2-methylpropoxy)phenyl]-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC(COc1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCN(C2)C)C

STK595064
Synonyms: (2'S,3S,3'S,10b'R)-2'-(furan-2-ylcarbonyl)-3'-[(3-nitrophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)cccc3)c1cccc(c1)[N+](=O)[O-]

STK595065
Synonyms: N-[4-(4-chlorophenyl)-6-methyl-2-(4-methylphenyl)-5-oxo-2,5-dihydropyridazin-3-yl]-4-methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1c(c2ccc(cc2)Cl)c(=O)c(nn1c1ccc(cc1)C)C

STK595066
Synonyms: (2S)-N-(4-chlorobenzyl)-2-(1-methyl-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanamide
Smiles: Clc1ccc(cc1)CNC(=O)[C@@H](n1c(=O)c2ccccc2n(c1=O)C)Cc1ccccc1

STK595067
Synonyms: N'-{(E)-[1-(2-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}heptanehydrazide
Smiles: CCCCCCC(=O)NN/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1C)S

STK595068
Synonyms: 7-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1-[3-(propan-2-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1cccc(c1)OC(C)C)c1noc(c1)C

STK595069
Synonyms: (3S,3'R,3a'R,6a'S)-5-bromo-5'-tert-butyl-3'-[(4-chlorophenyl)(hydroxy)methyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Clc1ccc(cc1)[C@H]([C@@H]1N[C@]2([C@@H]3[C@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cc(Br)cc1)O

STK595071
Synonyms: [10-(4-methoxyphenyl)-6,8-dioxo-2-thioxo-3,4a,5,5a,6,8,8a,9,9a,10-decahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindol-7(2H)-yl]aceticacid
Smiles: COc1ccc(cc1)C1C2C(Sc3c1sc(=S)[nH]3)C1CC2C2C1C(=O)N(C2=O)CC(=O)O

STK595072
Synonyms: 3-(5-{(E)-[1-(2-fluorobenzyl)-2-hydroxy-5-oxo-1,5-dihydro-4H-imidazol-4-ylidene]methyl}furan-2-yl)-2-methylbenzoicacid
Smiles: OC1=N/C(=C/c2ccc(o2)c2cccc(c2C)C(=O)O)/C(=O)N1Cc1ccccc1F

STK595073
Synonyms: 2-[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]-N-(pyridin-2-ylmethyl)propanamide
Smiles: O=C(C(Oc1ccc2c(c1C)oc(=O)c1c2CCCC1)C)NCc1ccccn1

STK595074
Synonyms: (E)-1-(4-methoxyphenyl)-N-{[10-methyl-11-(4-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}methanimine
Smiles: COc1ccc(cc1)/C=N/OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccc(cc1)C)c(C)nn2c1ccccc1

STK595077
Synonyms: 8-benzyl-4-hydroxy-1,6,7-trimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: O=c1nc(O)c2c(n1C)nc1n2c(C)c(n1Cc1ccccc1)C

STK595079
Synonyms: 7,7-dimethyl-2-phenyl-4-{[2-(piperidin-1-yl)ethyl]sulfanyl}-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: CC1(C)OCc2c(C1)nc(nc2SCCN1CCCCC1)c1ccccc1

STK595081
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-chlorophenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Cl)nnc1COc1ccc(cc1)Cl

STK595082
Synonyms: 9-(2-methylphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1ccccc1C

STK595083
Synonyms: (Z)-N-{[11-(4-chlorophenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}-1-phenylmethanimine
Smiles: Clc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CO/N=C\c1ccccc1)c1ccccc1

STK595084
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-bromo-2-fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1F)Br)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK595085
Synonyms: methyl4-[2-(6-methoxy-1,3-benzothiazol-2-yl)-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)C(=O)OC)c(=O)c1c(o2)cccc1

STK595086
Synonyms: (3a'S,6a'R)-5'-butyl-5-fluoro-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCCC)C(=O)Nc1c2cc(F)cc1

STK595089
Synonyms: 3-methyl-4-(4-methylphenyl)-1-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrazolo[3',4':4,5]pyrimido[2,1-b][1,3]benzothiazole
Smiles: Cc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1s2)c1ccccc1C(F)(F)F

STK595091
Synonyms: (3a'S,6a'R)-5'-butyl-3'-(3,4-dihydroxybenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cccc2

STK595094
Synonyms: 2-(3-bromophenyl)-10-methyl-3-propylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1cccc(c1)Br

STK595095
Synonyms: 1-[2-(9-methoxy-6H-indolo[2,3-b]quinoxalin-6-yl)ethyl]-5-methyl-1H-indole-2,3-dione
Smiles: COc1ccc2c(c1)c1nc3ccccc3nc1n2CCN1c2ccc(cc2C(=O)C1=O)C

STK595096
Synonyms: 8-amino-1',3,3'-trimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)N)C(=O)N(C)C(=O)N(C1=O)C

STK595097
Synonyms: (6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)(4-methoxy-3-nitrophenyl)methanone
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)c1ccc(c(c1)[N+](=O)[O-])OC

STK595098
Synonyms: 3-(3,4-dichlorobenzyl)-10-methyl-6-propyl-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: CCCc1cc(=O)oc2c1cc1CN(COc1c2C)Cc1ccc(c(c1)Cl)Cl

STK595100
Synonyms: 1-(4-ethoxyphenyl)-N-(2-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1OC)cc3c1ccc(cc1)C

STK595102
Synonyms: 4-methyl-2-(methylsulfonyl)-6-(propan-2-yl)quinazoline
Smiles: CC(c1ccc2c(c1)c(C)nc(n2)S(=O)(=O)C)C

STK595104
Synonyms: 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-5-phenylthieno[2,3-d]pyrimidine
Smiles: Cc1cc(C)nc(n1)N1CCN(CC1)c1ncnc2c1c(cs2)c1ccccc1

STK595105
Synonyms: dicyclohexyl[(2-methoxyphenyl)(phenylamino)methyl]phosphonate
Smiles: COc1ccccc1C(P(=O)(OC1CCCCC1)OC1CCCCC1)Nc1ccccc1

STK595107
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)-6-tert-butyl-3-[(E)-2-phenylethenyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: O=C1[C@H]2[C@@H](C(=O)N1C(C)(C)C)[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2/C=C/c1ccccc1

STK595108
Synonyms: N-(4-chloro-2-methylphenyl)-2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)Cl)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK595109
Synonyms: 7-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-8-(4-benzylpiperazin-1-yl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Cn1c(=O)nc(c2c1nc(n2CCSc1nc2c([nH]1)cccc2)N1CCN(CC1)Cc1ccccc1)O

STK595110
Synonyms: N-(4-chloro-2-methoxy-5-methylphenyl)-2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(Cl)c(cc1NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)Cl)C

STK595111
Synonyms: (3S,3'R,3a'R,6a'S)-5'-butyl-3'-[(4-chlorophenyl)(hydroxy)methyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)[C@@H]2[C@H](C1=O)[C@@]1(N[C@H]2[C@@H](c2ccc(cc2)Cl)O)C(=O)Nc2c1cccc2

STK595112
Synonyms: 1,3-dimethyl-7-(4-methylbenzyl)-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)Cn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK595113
Synonyms: 2-(4,6-dimethylpyrimidin-2-yl)-4-hydroxy-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: Cc1nnc(s1)SCc1cc(O)c2c(n1)[nH]n(c2=O)c1nc(C)cc(n1)C

STK595114
Synonyms: 2-(3-chlorophenyl)-5-(2-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccccc1C1Oc2ccccc2C2N1N=C(C2)c1cccc(c1)Cl

STK595115
Synonyms: 3-[(4-methylbenzyl)sulfanyl]-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-4-amine
Smiles: Cc1ccc(cc1)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK595116
Synonyms: (3'E)-3'-[1-benzofuran-2-yl(hydroxy)methylidene]-1-methyl-1'-(tetrahydrofuran-2-ylmethyl)spiro[indole-3,2'-pyrrolidine]-2,4',5'(1H)-trione
Smiles: O=C1C(=O)/C(=C(\c2cc3c(o2)cccc3)/O)/C2(N1CC1CCCO1)c1ccccc1N(C2=O)C

STK595117
Synonyms: (2S)-2-(4-oxoquinazolin-3(4H)-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
Smiles: O=C([C@@H](n1cnc2c(c1=O)cccc2)C)Nc1ccc(cc1)C(F)(F)F

STK595118
Synonyms: N'-[(E)-(7-chloro-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-8-yl)methylidene]pyridine-4-carbohydrazide
Smiles: Clc1nc2cc3OCCOc3cc2cc1/C=N/NC(=O)c1ccncc1

STK595120
Synonyms: N-butyl-5-methyl-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CCCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2

STK595121
Synonyms: 8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(=O)n(c(=O)n2C)C)C

STK595122
Synonyms: N-[4-(butan-2-yl)phenyl]-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1)C

STK595123
Synonyms: N-(3-chlorophenyl)-1-(3,4-dimethylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccc(c(c1)C)C)CCCC3)c1ccccc1

STK595124
Synonyms: (1Z)-1-{[(2-fluorophenyl)sulfonyl]methylidene}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2c(cc1OC)CCN/C/2=C\S(=O)(=O)c1ccccc1F

STK595127
Synonyms: 5-[3-(6-chloro-2-hydroxy-4-phenylquinolin-3-yl)-5-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1ccc(cc1)F)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STK595128
Synonyms: 2-{[4-(4-chlorophenyl)-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide
Smiles: COc1ccccc1c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1cc(C)ccc1C

STK595129
Synonyms: methylN-[(3,4-dimethylphenyl)carbamoyl]-D-methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1ccc(c(c1)C)C

STK595130
Synonyms: 2-[4-(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]ethanol
Smiles: OCCN1CCN(CC1)c1nc(C)nc2c1cc(s2)CC

STK595132
Synonyms: 9-(2-chlorophenyl)-6-(3,4-dimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1OC)C1CC(=C2C(=Nc3n(C2c2ccccc2Cl)ncn3)C1)O

STK595135
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[3,5-bis(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK595139
Synonyms: (5E)-5-({[3-(furan-2-yl)-3-(4-methylphenyl)propyl]amino}methylidene)-1-(prop-2-en-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: C=CCN1C(=NC(=O)/C(=C\NCCC(c2ccco2)c2ccc(cc2)C)/C1=O)S

STK595140
Synonyms: 4-{[(E)-biphenyl-4-ylmethylidene]amino}-5-(3-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)c1ccccc1

STK595141
Synonyms: 2-(ethylsulfanyl)-6,6-dimethyl-9-(2-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CC(C1)(C)C)C2c1ccccc1[N+](=O)[O-]

STK595142
Synonyms: (4E)-5-(3-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
Smiles: CSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1cccc(c1)Cl

STK595146
Synonyms: 3-{[5-tert-butyl-3-(4-chlorophenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}pentane-2,4-dione
Smiles: CC(=O)C(C(=O)C)Sc1cc(nc2n1nc(c2c1ccc(cc1)Cl)C)C(C)(C)C

STK595147
Synonyms: 1-(3-chlorophenyl)-3-[N-(2,5-dimethoxyphenyl)-N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]urea
Smiles: COc1ccc(c(c1)N/C(=N\c1nc(C)cc(n1)C)/NC(=O)Nc1cccc(c1)Cl)OC

STK595148
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1COc1ccccc1

STK595149
Synonyms: N-[(3Z)-1-butyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-nitrobenzenesulfonamide
Smiles: CCCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])/c2c1nc1ccccc1c2

STK595151
Synonyms: (4Z)-6-{[4-(3-methoxyphenyl)piperazin-1-yl]methyl}-4-[(4-methylphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: COc1cccc(c1)N1CCN(CC1)Cc1nc(N)n/c(=N\c2ccc(cc2)C)/[nH]1

STK595153
Synonyms: N-(2,4-dimethoxyphenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK595154
Synonyms: 2,2,5-trimethyl-N-(tetrahydrofuran-2-ylmethyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCC1CCCO1

STK595156
Synonyms: 8-[(dibenzylamino)methyl]-6-hydroxy-3-methyl-7-(2-oxopropyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(=O)Cn1c(CN(Cc2ccccc2)Cc2ccccc2)nc2c1c(O)nc(=O)n2C

STK595158
Synonyms: 8-[(4-benzylpiperidin-1-yl)methyl]-7-(3-hydroxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCCn1c(CN2CCC(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK595159
Synonyms: (6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)[2-(thiophen-2-yl)quinolin-4-yl]methanone
Smiles: COc1cc2CCN(C(c2cc1OC)C)C(=O)c1cc(nc2c1cccc2)c1cccs1

STK595162
Synonyms: 2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]-N-(pyridin-2-ylmethyl)propanamide
Smiles: O=C(C(Oc1cc(C)cc2c1c1CCCc1c(=O)o2)C)NCc1ccccn1

STK595163
Synonyms: N-(2-chlorophenyl)-1-(4-chlorophenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Cc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1Cl)c1ccc(cc1)Cl

STK595164
Synonyms: methylN-[(3-methylphenyl)carbamoyl]-D-alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1cccc(c1)C)C

STK595165
Synonyms: (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-ethoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)Cl)C)/C1=O)S

STK595167
Synonyms: 4-hydroxy-1,6,7-trimethyl-8-(4-phenoxyphenyl)-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Oc1nc(=O)n(c2c1n1c(n2)n(c(c1C)C)c1ccc(cc1)Oc1ccccc1)C

STK595168
Synonyms: 1-methyl-9-(2-phenylethyl)-3-[(2E)-3-phenylprop-2-en-1-yl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: O=c1n(C)c2nc3n(c2c(=O)n1C/C=C/c1ccccc1)CCCN3CCc1ccccc1

STK595169
Synonyms: 3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)/C1=O)C

STK595170
Synonyms: 2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccccc1)C

STK595171
Synonyms: N-[2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzyl]acetamide
Smiles: CC(=O)NCc1cc(ccc1C)c1nnc2n1nc(C)c1c2cccc1

STK595172
Synonyms: 3-[(3a'S,6a'R)-5-chloro-5'-(2-chlorobenzyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanamide
Smiles: NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cc(Cl)cc1

STK595173
Synonyms: 2-ethyl-3-methyl-1-[(2E)-2-(quinoxalin-2-ylmethylidene)hydrazinyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1cnc3c(n1)cccc3)c1ccccc1n2

STK595174
Synonyms: 9-(4-fluorophenyl)-6-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1c(OC)cc(cc1OC)C1CC(=C2C(=Nc3n(C2c2ccc(cc2)F)ncn3)C1)O

STK595175
Synonyms: 2',6'-dihydroxy-15,16-dihydro-4'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-4',7-dione
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2

STK595176
Synonyms: 1'-benzyl-2'-hydroxy-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: OC1=NC(=O)C2(C(=O)N1Cc1ccccc1)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2

STK595177
Synonyms: (3S,3a'R,8a'S,8b'S)-7-chloro-2'-(2,4-dimethylphenyl)-5-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(C)cc2Cl

STK595178
Synonyms: (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(cc1)[N+](=O)[O-]

STK595181
Synonyms: 4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1c(cccc1OC)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC(C)C

STK595182
Synonyms: 5-(2,5-dimethoxyphenyl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-1H-pyrazole-3-carbohydrazide
Smiles: COc1ccc(c(c1)c1[nH]nc(c1)C(=O)N/N=C/c1ccc(c(c1)OC)OC)OC

STK595183
Synonyms: N-[6-chloro-3-(4-fluorophenyl)-4-oxo-4H-chromen-2-yl]thiophene-2-carboxamide
Smiles: Fc1ccc(cc1)c1c(NC(=O)c2cccs2)oc2c(c1=O)cc(cc2)Cl

STK595184
Synonyms: 3-[(4-methoxybenzyl)sulfanyl]-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCc3ccc(cc3)OC)nnc2c2c1CC(C)(C)OC2

STK595186
Synonyms: 4-(4-benzylpiperazin-1-yl)-2-methyl[1]benzofuro[3,2-d]pyrimidine
Smiles: Cc1nc(N2CCN(CC2)Cc2ccccc2)c2c(n1)c1ccccc1o2

STK595187
Synonyms: (6E)-6-[(3-chloro-2-methylphenyl)imino]-4-(3-methyl-1-benzofuran-2-yl)-1,6-dihydro-1,3,5-triazin-2-amine
Smiles: Nc1[nH]/c(=N\c2cccc(c2C)Cl)/nc(n1)c1oc2c(c1C)cccc2

STK595188
Synonyms: 2-methyl-3-(4-methylphenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: Cc1ccc(cc1)n1c(C)nc2c(c1=O)c(=O)c1c(o2)cccc1

STK595189
Synonyms: N-(2,4-difluorophenyl)-6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)hexanamide
Smiles: O=C(Nc1ccc(cc1F)F)CCCCCn1nnc2c(c1=O)cccc2

STK595192
Synonyms: 3-[(4-chlorophenoxy)methyl]-5-[(2,5-dimethylbenzyl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(nnc1SCc1cc(C)ccc1C)COc1ccc(cc1)Cl

STK595193
Synonyms: 4-(4-methoxyphenyl)-N-(4-methylphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccc(cc1)C)c1ccccc1

STK595194
Synonyms: (1Z,2E)-1-{2-(4-ethoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}-3-phenylprop-2-en-1-olate
Smiles: CCOc1ccc(cc1)C1/C(=C(\C=C\c2ccccc2)/[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STK595195
Synonyms: methyl4,5-dimethoxy-2-{[2-(4-oxoquinazolin-3(4H)-yl)butanoyl]amino}benzoate
Smiles: COC(=O)c1cc(OC)c(cc1NC(=O)C(n1cnc2c(c1=O)cccc2)CC)OC

STK595196
Synonyms: 9-(3-fluorophenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1cccc(c1)F

STK595197
Synonyms: 5-(4-chlorophenyl)-4-(2-fluorophenyl)-3-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: Clc1ccc(cc1)N1C(=O)c2c(C1c1ccccc1F)c([nH]n2)c1ccccc1

STK595198
Synonyms: 7-(4-fluorobenzyl)-6-hydroxy-8-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: COc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccc(cc1)F)c(O)nc(=O)n2C

STK595199
Synonyms: (4E)-5-(4-fluorophenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
Smiles: CSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2cccs2)/O)/C1c1ccc(cc1)F

STK595201
Synonyms: 1-(4-bromophenyl)-N-(2-methylphenyl)-4-oxo-2-[4-(propan-2-yl)phenyl]azetidine-2-carboxamide
Smiles: Brc1ccc(cc1)N1C(=O)CC1(c1ccc(cc1)C(C)C)C(=O)Nc1ccccc1C

STK595202
Synonyms: 2-(2-{[4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-yl]amino}ethoxy)ethanol
Smiles: OCCOCCNc1ncnc2c1oc1c2c2CCCc2c(n1)C(C)C

STK595203
Synonyms: (3S,3a'R,8a'S,8b'S)-5-chloro-2'-(2,5-dichlorophenyl)-7-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Clc1ccc(c(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2C)Cl

STK595204
Synonyms: 4-fluoro-N-[5-hydroxy-2-(phenoxymethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1cc(O)nc2n1nc(n2)COc1ccccc1

STK595205
Synonyms: 8-[benzyl(methyl)amino]-6-hydroxy-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Cc1cccc(c1)OCC(Cn1c(nc2c1c(O)nc(=O)n2C)N(Cc1ccccc1)C)O

STK595206
Synonyms: N-(4-ethoxyphenyl)-N'-(3-methyl-1-phenyl-1H-pyrazol-5-yl)quinoxaline-2,3-diamine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2nc1Nc1cc(nn1c1ccccc1)C

STK595207
Synonyms: N-(2,4-dichlorophenyl)-2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2Cl)Cl)nnc1COc1ccc(cc1)C

STK595208
Synonyms: methyl4-({[(2S)-1-methoxy-1-oxopropan-2-yl]carbamoyl}amino)benzoate
Smiles: COC(=O)[C@@H](NC(=O)Nc1ccc(cc1)C(=O)OC)C

STK595209
Synonyms: 2-[3-(furan-2-ylmethyl)-2,4-dioxo-3,4,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]-N-phenylacetamide
Smiles: O=C(Cn1c(=O)n(Cc2ccco2)c(=O)c2c1sc1c2CCCCC1)Nc1ccccc1

STK595211
Synonyms: 9-[4-(dimethylamino)phenyl]-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nc2n(n1)C(c1ccc(cc1)N(C)C)C1=C(O)CCCC1=N2

STK595212
Synonyms: 4-(1,4-dioxa-8-azoniaspiro[4.5]dec-8-ylmethyl)-6-ethyl-2-oxo-2H-chromen-7-olate
Smiles: CCc1cc2c(cc1[O-])oc(=O)cc2C[NH+]1CCC2(CC1)OCCO2

STK595213
Synonyms: (3a'S,6a'R)-5'-butyl-5-chloro-3'-(2-methylpropyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1cc(Cl)cc2

STK595214
Synonyms: 2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1)C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK595215
Synonyms: N-(4-butylphenyl)-2-{[4-methyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1C)c1ccc(cc1)C

STK595217
Synonyms: 3-[(3a'S,6a'R)-5-chloro-5'-(3-methoxypropyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanamide
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cc(Cl)cc2

STK595218
Synonyms: 2-chloro-N-[1-methyl-4-oxo-3-(3,4,5-trimethoxyphenyl)-1,4-dihydroquinolin-2-yl]benzamide
Smiles: COc1cc(cc(c1OC)OC)c1c(NC(=O)c2ccccc2Cl)n(C)c2c(c1=O)cccc2

STK595219
Synonyms: 4-chloro-N-(2-methoxyphenyl)-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: COc1ccccc1N(S(=O)(=O)c1ccc(cc1)Cl)Cc1cc2cccc(c2[nH]c1=O)C

STK595220
Synonyms: (1Z,2E)-1-{2-[4-(dimethylamino)phenyl]-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}-3-phenylprop-2-en-1-olate
Smiles: CN(c1ccc(cc1)C1/C(=C(\C=C\c2ccccc2)/[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1)C

STK595222
Synonyms: 6-ethyl-2-methyl-4-(3-methylphenyl)pyridazino[3',4':4,5]pyrimido[1,6-a]benzimidazol-1(4H)-one
Smiles: CCc1nc2n(nc(c(=O)c2c2n1c1ccccc1n2)C)c1cccc(c1)C

STK595226
Synonyms: 2-ethyl-N-[(2E)-3-(3-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]butanamide
Smiles: CCC(C(=O)/N=C\1/SC2C(N1Cc1cccc(c1)OC)CS(=O)(=O)C2)CC

STK595227
Synonyms: 7'-{(Z)-[4-hydroxy-1-(2-methoxyphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trio
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C/c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK595233
Synonyms: 2-chloro-4-{(Z)-[2-(4-chloro-3-nitrophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-6-methoxyphenylacetate
Smiles: COc1cc(/C=C/2\N=C(OC2=O)c2ccc(c(c2)[N+](=O)[O-])Cl)cc(c1OC(=O)C)Cl

STK595234
Synonyms: (3S,3a'R,8a'S,8b'S)-7-chloro-2'-[2-chloro-5-(trifluoromethyl)phenyl]-5-methyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Cc1cc(Cl)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1Cl)C(F)(F)F

STK595237
Synonyms: (4E)-5-(4-hydroxy-3-methoxyphenyl)-4-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1O)C1N(c2cccc(c2)C(F)(F)F)C(=O)C(=O)/C/1=C(\C=C\c1ccccc1)/O

STK595238
Synonyms: 2-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-[2-(3-fluorophenyl)ethyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C)NCCc1cccc(c1)F

STK595239
Synonyms: 2-{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-1-phenylethanone
Smiles: COc1ccc(cc1)c1nc(SCC(=O)c2ccccc2)c2c(n1)CC(OC2)(C)C

STK595240
Synonyms: N-butyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
Smiles: CCCCN(S(=O)(=O)c1ccccc1)Cc1cc2ccccc2[nH]c1=O

STK595241
Synonyms: N-(4-chlorophenyl)-1-(4-ethylphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccc(cc1)Cl)cc3c1ccc(cc1)C

STK595242
Synonyms: 8,8-dimethyl-3-[(4-nitrobenzyl)sulfanyl]-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCc3ccc(cc3)[N+](=O)[O-])nnc2c2c1CC(C)(C)OC2

STK595245
Synonyms: N-(4-butylphenyl)-2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1CC)c1ccc(cc1)C

STK595246
Synonyms: N-(3-acetylphenyl)-2-(1,3-benzothiazol-2-yl)pyridine-3-carboxamide
Smiles: O=C(c1cccnc1c1nc2c(s1)cccc2)Nc1cccc(c1)C(=O)C

STK595248
Synonyms: (4Z)-4-(3-bromo-4-nitrobenzylidene)-2-(2-fluorophenyl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(c(c1)Br)[N+](=O)[O-])c1ccccc1F

STK595249
Synonyms: 4-({(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}amino)-5-(2-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(ccc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccccc1Br

STK595250
Synonyms: 3-[(3a'S,6a'R)-5'-(2-chlorobenzyl)-7-methyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanamide
Smiles: NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cccc1C

STK595251
Synonyms: N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1cc(Cl)c(cc1OC)OC

STK595252
Synonyms: 3-(2-fluorobenzyl)-1,7-dimethyl-8-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Fc1ccccc1Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccccc1)C

STK595253
Synonyms: 2-{[3-cyano-5-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2c(C)cccc2C)N=C2C(=C(O)CCC2)C1c1ccc(c(c1)OC)O

STK595254
Synonyms: 2-ethyl-3-methyl-1-[(2E)-2-(quinoxalin-5-ylmethylidene)hydrazinyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1cccc3c1nccn3)c1ccccc1n2

STK595260
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(4-chlorophenyl)carbonyl]-3'-[(3-nitrophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccc(c2)[N+](=O)[O-])N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK595261
Synonyms: 1',3',4-trimethyl-3,4-dihydro-1H,2'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)CN(C)c1c(C2)c2ccccc2cc1

STK595262
Synonyms: 2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1Cc1cccs1

STK595263
Synonyms: 2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1C(F)(F)F)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK595264
Synonyms: 3-[(4-bromobenzyl)oxy]-1-hydroxy-5-methyl-9H-xanthen-9-one
Smiles: Brc1ccc(cc1)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK595265
Synonyms: N'-[(E)-(4-ethoxyphenyl)methylidene]-4,5-dimethoxy-1H-indole-2-carbohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)ccc(c2OC)OC

STK595266
Synonyms: N,4-di-tert-butyl-N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(C)(C)C)C(=O)c1ccc(cc1)C(C)(C)C

STK595268
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(3-chlorophenyl)-7-ethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)Cl

STK595269
Synonyms: 2-(4-phenylpiperazin-1-yl)-5,6,7,8-tetrahydroquinazolin-4-ol
Smiles: Oc1nc(nc2c1CCCC2)N1CCN(CC1)c1ccccc1

STK595270
Synonyms: 5-fluoro-N-methyl-N-(1-methylpiperidin-4-yl)-1H-indole-2-carboxamide
Smiles: CN1CCC(CC1)N(C(=O)c1cc2c([nH]1)ccc(c2)F)C

STK595271
Synonyms: 2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide
Smiles: O=C(CN1C(=O)S/C(=C\c2ccccc2)/C1=O)NC1CCS(=O)(=O)C1

STK595273
Synonyms: 4-[2,6,8-trioxo-10-(thiophen-2-yl)-3,4a,5,5a,6,8,8a,9,9a,10-decahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindol-7(2H)-yl]butanoicacid
Smiles: OC(=O)CCCN1C(=O)C2C(C1=O)C1CC2C2C1Sc1c(C2c2cccs2)sc(=O)[nH]1

STK595274
Synonyms: (5Z)-5-(furan-2-ylmethylidene)-3-{3-oxo-3-[2-(pyridin-3-yl)piperidin-1-yl]propyl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2ccco2)/C(=O)N1CCC(=O)N1CCCCC1c1cccnc1

STK595275
Synonyms: (6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)[4-(trifluoromethoxy)phenyl]methanone
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)c1ccc(cc1)OC(F)(F)F

STK595276
Synonyms: 5-(4-chlorophenyl)-3-(2-hydroxyphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: OC(=O)C1NC(C2C1C(=O)N(C2=O)c1ccc(cc1)Cl)c1ccccc1O

STK595277
Synonyms: ethyl2-{(3E)-2-[3-ethoxy-4-(pentyloxy)phenyl]-3-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)OCC

STK595278
Synonyms: (2E)-3-(2,5-dichlorophenyl)-2-(4-hydroxyquinazolin-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc(Cl)ccc1Cl)/c1nc(O)c2c(n1)cccc2

STK595279
Synonyms: N-(3-chloro-4-fluorophenyl)-2-{[4-(4-chlorophenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK595280
Synonyms: 2-{[3-cyano-5-hydroxy-4-(thiophen-2-yl)-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C)N=C2C(=C(O)CCC2)C1c1cccs1

STK595283
Synonyms: 1-(4-ethoxyphenyl)-4-(4-methoxyphenyl)-N-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1)cc3c1ccc(cc1)OC

STK595284
Synonyms: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-6-methyl-5-(naphthalen-1-ylmethyl)pyrimidin-4-ol
Smiles: Cc1nc(nc(c1Cc1cccc2c1cccc2)O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK595285
Synonyms: N-(2,6-dimethylphenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nnc1COc1ccccc1

STK595286
Synonyms: 3-(2-methyl-1H-benzimidazol-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide
Smiles: O=C(CCn1c(C)nc2c1cccc2)NCCCN1CCCC1=O

STK595288
Synonyms: (3R,3'S,3a'S,6a'R)-3'-benzyl-6-chloro-5'-cyclohexyl-7-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: O=C1N(C2CCCCC2)C(=O)[C@@H]2[C@H]1[C@H](Cc1ccccc1)N[C@@]12C(=O)Nc2c1ccc(c2C)Cl

STK595289
Synonyms: 2-[(3R,3'S,3a'S,6a'R)-5'-(3,4-dichlorophenyl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: NC(=O)C[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(c(c1)Cl)Cl)C(=O)Nc1c2cccc1

STK595291
Synonyms: N-(4-butylphenyl)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CN1CCc2c(C1)cc(c(c2)OC)OC

STK595292
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-(butan-2-yl)phenyl]acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1cc([nH]n1)c1ccc(cc1)Cl)C

STK595293
Synonyms: 8-[(2,4,6-trimethylphenyl)sulfonyl]-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: Cc1cc(C)c(c(c1)C)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK595294
Synonyms: 1-(phenylcarbonyl)-N-[3-(1H-tetrazol-1-yl)phenyl]piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)C(=O)c1ccccc1)Nc1cccc(c1)n1cnnn1

STK595295
Synonyms: 4-{[(E)-(3,4-dichlorophenyl)methylidene]amino}-5-(3-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)Cl)Cl

STK595296
Synonyms: N-(3-methoxypropyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
Smiles: COCCCNC(=O)c1c2CCCc2nc2c1cccc2

STK595298
Synonyms: 1-(2-fluorophenyl)-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1F)c(=O)c1c(o2)cccc1

STK595300
Synonyms: 6-chloro-3-[(Z)-(4-hydroxy-2-thioxo-1,3-thiazol-5(2H)-ylidene)methyl]-4H-chromen-4-one
Smiles: OC1=NC(=S)S/C/1=C\c1coc2c(c1=O)cc(cc2)Cl

STK595301
Synonyms: 4-{[({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)N)nnc1COc1ccc(cc1)Cl

STK595302
Synonyms: methyl4-methoxy-3-[(5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)methyl]benzoate
Smiles: COC(=O)c1ccc(c(c1)Cn1c2ccccc2c2c1c(=O)n1CCSc1n2)OC

STK595303
Synonyms: 2,2-dimethyl-5-propyl-N-(pyridin-4-ylmethyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-amine
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCc1ccncc1

STK595306
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-(benzyloxy)phenyl]acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)OCc1ccccc1

STK595308
Synonyms: 4-(4-hydroxy-3-methoxyphenyl)-1-[3-(trifluoromethyl)phenyl]-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1cc(ccc1O)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)C(F)(F)F

STK595310
Synonyms: (4Z)-4-(4-chlorobenzylidene)-2-(2-chlorophenyl)-4H-imidazol-5-ol
Smiles: Clc1ccc(cc1)/C=C/1\N=C(N=C1O)c1ccccc1Cl

STK595311
Synonyms: N-(3,5-dichlorophenyl)-2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK595314
Synonyms: 3-[(3R,3'S,3a'S,6a'R)-5'-(naphthalen-2-yl)-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanoicacid
Smiles: OC(=O)CC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc3c(c1)cccc3)C(=O)Nc1c2cccc1

STK595315
Synonyms: 7-(3-chlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1cccc(c1)n1ncc2c1ncn1c2nnc1

STK595316
Synonyms: 9-(5-methyl-1,2-oxazol-3-yl)-8-(3-propoxyphenyl)-8,9-dihydrobenzo[7,8]chromeno[2,3-c]pyrrole-7,10-dione
Smiles: CCCOc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK595318
Synonyms: 5-[3-(6-chloro-2-hydroxy-4-phenylquinolin-3-yl)-5-(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1ccccc1Cl)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STK595319
Synonyms: 4-(3-chlorophenyl)-8-methyl-1-thioxo-2,4,6,7,8,9-hexahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(=S)[nH]n2)c1cccc(c1)Cl

STK595320
Synonyms: 2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(pyridin-4-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1cc(C)c2c(c1)sc(n2)N1C(=O)c2c(C1c1ccncc1)c(=O)c1c(o2)cccc1

STK595321
Synonyms: 2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-N-methylacetamide
Smiles: Oc1ccc(cc1)C(CN(C(=O)CN1C(=O)S/C(=C\c2ccccc2)/C1=O)C)O

STK595323
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-(2-fluorophenyl)pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1c1nnc(s1)SCc1ccccc1F)c1ccccc1F

STK595325
Synonyms: 5-(2-bromophenyl)-4-{[(E)-(3,4-dichlorophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Brc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)Cl)Cl

STK595326
Synonyms: 8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-[4-(methoxycarbonyl)phenoxy]-4-oxo-4H-chromen-7-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)Oc1ccc(cc1)C(=O)OC

STK595328
Synonyms: 7-(2,3-dimethylphenyl)-3-(4-nitrophenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: O=C1CC2(C(=O)N1c1cccc(c1C)C)ON=C(C2)c1ccc(cc1)[N+](=O)[O-]

STK595329
Synonyms: N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc2c(c1)OCO2)C(C)C

STK595330
Synonyms: 7-hydrazinyl-2-methyl-3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidine
Smiles: NNc1cc(nc2n1nc(c2c1ccccc1)C)C(C)C

STK595332
Synonyms: 8-(3-chlorophenyl)-2-(4-fluorophenyl)-10-methyl-11-(pyridin-3-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Fc1ccc(cc1)c1nn2c(n1)c1c(nc2)Oc2c(C1c1cccnc1)c(C)nn2c1cccc(c1)Cl

STK595334
Synonyms: 4-tert-butyl-N-[3-(1H-tetrazol-1-yl)phenyl]benzamide
Smiles: O=C(c1ccc(cc1)C(C)(C)C)Nc1cccc(c1)n1cnnn1

STK595335
Synonyms: (3a'S,6a'R)-5-chloro-5'-(4-fluorobenzyl)-3'-(1-hydroxyethyl)-7-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cc(Cl)cc2C

STK595336
Synonyms: 3-ethyl-10-fluoro-1',3'-dimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CCN1CCN2C(C1)C1(Cc3c2c(F)ccc3)C(=O)N(C)C(=O)N(C1=O)C

STK595338
Synonyms: 1-(2,4-dichlorophenyl)-3-[N'-(4,6-dimethylpyrimidin-2-yl)-N-(2-methylphenyl)carbamimidoyl]urea
Smiles: O=C(Nc1ccc(cc1Cl)Cl)N/C(=N\c1nc(C)cc(n1)C)/Nc1ccccc1C

STK595340
Synonyms: 1-(3,4-dimethoxyphenyl)-7-fluoro-2-(6-methylpyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(ccc1OC)C1N(c2cccc(n2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK595342
Synonyms: 3-butyl-1-methyl-8-(2-methylphenyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: CCCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C

STK595343
Synonyms: ethyl4-(4-hydroxy-1-methyl-2-oxo-1,2,6,7-tetrahydro-8H-imidazo[2,1-f]purin-8-yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CCn2c1nc1c2c(O)nc(=O)n1C

STK595344
Synonyms: 8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(2-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cccc(c1)N1CCN(CC1)Cc1nc2c(n1Cc1ccccc1C)c(=O)n(c(=O)n2C)C

STK595345
Synonyms: 1'-cyclohexyl-2'-hydroxy-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: OC1=NC(=O)C2(C(=O)N1C1CCCCC1)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2

STK595346
Synonyms: 2',6'-dihydroxy-8-nitro-3-(pyridin-2-yl)-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-4'-one
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(ccc1N1C2CN(CC1)c1ccccn1)[N+](=O)[O-]

STK595347
Synonyms: (3R,3'S,5'R)-5'-(2-amino-2-oxoethyl)-5-chloro-N-(4-methoxyphenyl)-7-methyl-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(Cl)cc1C)CC(=O)N

STK595349
Synonyms: N-(4-fluorophenyl)-2-{[4-(4-methoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)F)nnc1COc1ccccc1

STK595350
Synonyms: 2-(4,6-dimethylpyrimidin-2-yl)-4-hydroxy-6-{[(4-methylphenyl)sulfanyl]methyl}-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: Cc1ccc(cc1)SCc1cc(O)c2c(n1)[nH]n(c2=O)c1nc(C)cc(n1)C

STK595351
Synonyms: N-[(2Z)-3-(1,3-benzodioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3-methylbutanamide
Smiles: CC(CC(=O)/N=C/1\SC2C(N1c1ccc3c(c1)OCO3)CS(=O)(=O)C2)C

STK595353
Synonyms: N-{(2S)-1-[(3,4-dimethoxybenzyl)amino]-3-methyl-1-oxobutan-2-yl}-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: COc1cc(CNC(=O)[C@H](C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(cc2)C)ccc1OC

STK595354
Synonyms: N-{(1Z)-1-[1-cyano-2-oxo-2-(phenylamino)ethylidene]-1H-isoindol-3-yl}-4-methylbenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C)/C(=O)Nc1ccccc1

STK595355
Synonyms: ethyl6'-amino-1-(2-chlorobenzyl)-5'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C21c1ccccc1N(C2=O)Cc1ccccc1Cl)C#N)N

STK595356
Synonyms: (8S,8aR,11aS)-10-benzyl-8-[(2,5-dimethoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1C=Cc1c2cccc1)Cc1ccccc1)OC

STK595357
Synonyms: N-[(2E)-3-(2-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)CC(=O)/N=C\1/SC2C(N1c1ccccc1F)CS(=O)(=O)C2

STK595358
Synonyms: N-[2-(7-methoxy-6-{(E)-[2-(pyridin-4-ylcarbonyl)hydrazinylidene]methyl}-1,3-benzodioxol-5-yl)ethyl]-N-methylpropanamide
Smiles: CCC(=O)N(CCc1cc2OCOc2c(c1/C=N/NC(=O)c1ccncc1)OC)C

STK595359
Synonyms: 2-[3-(4-chlorophenyl)-7-ethyl-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]acetamide
Smiles: CCN1CCc2c(C1)sc1c2c(=O)n(c(=O)n1CC(=O)N)c1ccc(cc1)Cl

STK595361
Synonyms: 2-(4-fluorophenyl)-N-[2-(1H-imidazol-5-yl)ethyl]acetamide
Smiles: O=C(Cc1ccc(cc1)F)NCCc1[nH]cnc1

STK595363
Synonyms: 5-(2-fluorophenyl)-4-{[(E)-(2-methoxynaphthalen-1-yl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc2c(c1/C=N/n1c(=S)[nH]nc1c1ccccc1F)cccc2

STK595364
Synonyms: N-(2-bromo-4,6-difluorophenyl)-2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2c(F)cc(cc2Br)F)nnc1c1cccc(c1)Cl

STK595366
Synonyms: (4E)-5-(2-chlorophenyl)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)[N+](=O)[O-])/O)/C1c1ccccc1Cl

STK595367
Synonyms: 8-(4-chlorophenyl)-11-(4-methoxyphenyl)-10-methyl-2-(pyridin-3-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1cccnc1)c1ccc(cc1)Cl

STK595368
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(3,4-dimethoxyphenyl)carbonyl]-3'-(pyridin-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cc(ccc1OC)C(=O)[C@@H]1[C@@H](C(=O)c2ccccn2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK595369
Synonyms: 1-[3-(4-chlorophenyl)-4-phenylbutyl]pyrrolidine
Smiles: Clc1ccc(cc1)C(Cc1ccccc1)CCN1CCCC1

STK595370
Synonyms: N-(4-acetylphenyl)-3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)Nc1ccc(cc1)C(=O)C

STK595372
Synonyms: 8-[(4-methylphenyl)sulfonyl]-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK595373
Synonyms: 4-{[(E)-(4-ethoxyphenyl)methylidene]amino}-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1OC

STK595376
Synonyms: 3-[(8-methyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino]propan-1-ol
Smiles: OCCCNc1nc2nnnn2c2c1c1CCN(Cc1s2)C

STK595377
Synonyms: 2-(6-fluoro-1,3-benzothiazol-2-yl)-1-(2-methoxyphenyl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccccc1C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK595378
Synonyms: 8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hexyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(CN2CCN(CC2)c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C

STK595379
Synonyms: 1-benzyl-2-[(4-methylpiperazin-1-yl)carbonyl]pyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-4(1H)-one
Smiles: CN1CCN(CC1)C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK595381
Synonyms: methyl[(2-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CCCC3

STK595382
Synonyms: (3a'S,6a'R)-5'-tert-butyl-7-methyl-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC(C1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1C)C

STK595383
Synonyms: (4E)-4-[(3-chlorophenyl)imino]-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc(N)n/c(=N/c2cccc(c2)Cl)/[nH]1

STK595384
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-ethyl-6-methylphenyl)acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl)C

STK595385
Synonyms: 2-[(2-chlorobenzyl)sulfanyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1cc(O)n2c(n1)nc(n2)SCc1ccccc1Cl

STK595386
Synonyms: 2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-11-(2-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CSc1nc2c(o1)cccc2)c1ccccc1

STK595387
Synonyms: (1'R,2'S)-7'-chloro-2'-(2-chlorophenyl)-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Clc1ccc2c(c1)C=CC1N2[C@@H](C(=O)c2ccccc2)[C@@H]([C@@]21C(=O)c1c(C2=O)cccc1)c1ccccc1Cl

STK595388
Synonyms: (3a'S,6a'R)-3'-(1-hydroxyethyl)-5'-(3-methoxypropyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cccc2

STK595389
Synonyms: 8-(3-chlorophenyl)-10-methyl-2-[(4-methylphenoxy)methyl]-11-(pyridin-3-yl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1cccnc1)c(C)nn2c1cccc(c1)Cl

STK595393
Synonyms: tert-butyl[(1S)-1-{5-[(3-chlorobenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}-2-phenylethyl]carbamate
Smiles: Clc1cccc(c1)CS(=O)(=O)c1nnc(o1)[C@@H](NC(=O)OC(C)(C)C)Cc1ccccc1

STK595395
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[methyl(phenyl)amino]methyl}-N'-[(1E)-1-(4-nitrophenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN(c1ccccc1)C)c1nonc1N)N/N=C(/c1ccc(cc1)[N+](=O)[O-])\C

STK595396
Synonyms: (4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(4-methoxyphenyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)OC)N(C(=O)C1=O)c1cccc(c1)C(F)(F)F)/O

STK595397
Synonyms: N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylpropyl)thiophene-2-carboxamide
Smiles: CC(CN(C(=O)c1cccs1)Cc1cc2cccc(c2[nH]c1=O)C)C

STK595398
Synonyms: 2,2,7',9',9'-pentamethyl-3'-nitro-6a',7',8',9',10',11'-hexahydro-5'H-spiro[1,3-dioxane-5,6'-[7,11]methanoazepino[1,2-a]quinoline]-4,6-dione
Smiles: [O-][N+](=O)c1ccc2c(c1)CC1(C3N2C2CC(CC3(C2)C)(C)C)C(=O)OC(OC1=O)(C)C

STK595400
Synonyms: 4-(3,5-dimethylphenoxy)-2-[4-(propan-2-yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(Oc2cc(C)cc(c2)C)c2c(n1)cccc2)C

STK595401
Synonyms: 2-{[2-(methylsulfanyl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl]amino}ethanol
Smiles: OCCNc1nc(SC)nc2c1c1CCCc1s2

STK595402
Synonyms: N-(4-butylphenyl)-2-{[5-(4-tert-butylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)CCCC)nnc1c1ccc(cc1)C(C)(C)C

STK595403
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1C(F)(F)F)Cl

STK595404
Synonyms: 2-(benzylsulfanyl)-9-(4-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1ccc(cc1)C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1ccccc1

STK595405
Synonyms: 1'-butyl-3-(4-chlorophenyl)-6-hydroxy-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: CCCC1N(CCCC)c2ccc(cc2CC21C(=NC(=O)N(C2=O)c1ccc(cc1)Cl)O)[N+](=O)[O-]

STK595408
Synonyms: (5E)-2-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1ccc(o1)c1cccc(c1)C(F)(F)F)N1CCN(CC1)c1ccc(c(c1)Cl)C

STK595409
Synonyms: (E)-{2-(4-bromophenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-fluorophenyl)methanolate
Smiles: Brc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)F)/[O-]

STK595412
Synonyms: N-[(2E)-3-(1,3-benzodioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylbutanamide
Smiles: CCC(C(=O)/N=C\1/SC2C(N1c1ccc3c(c1)OCO3)CS(=O)(=O)C2)C

STK595413
Synonyms: N-[1-(1H-benzimidazol-2-yl)-3-methyl-1H-pyrazol-5-yl]-2,4-difluorobenzamide
Smiles: Fc1ccc(c(c1)F)C(=O)Nc1cc(nn1c1nc2c([nH]1)cccc2)C

STK595414
Synonyms: methyl2-amino-4-(2,3-dichlorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: COC(=O)C1=C(N)Oc2c(C1c1cccc(c1Cl)Cl)oc(cc2=O)CO

STK595415
Synonyms: N,N-diethyl-N'-(2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)propane-1,3-diamine
Smiles: CCN(CCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C)CC

STK595416
Synonyms: (2E)-3-(5-bromofuran-2-yl)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)prop-2-en-1-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)/C=C/c1ccc(o1)Br

STK595417
Synonyms: N-(4-fluorobenzyl)-2-(6-oxo-3,4-dihydro-2H-[1,3]thiazino[3',2':1,2]pyrimido[5,4-b]indol-7(6H)-yl)acetamide
Smiles: O=C(Cn1c2ccccc2c2c1c(=O)n1CCCSc1n2)NCc1ccc(cc1)F

STK595418
Synonyms: (6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)[2-(thiophen-2-yl)quinolin-4-yl]methanone
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)c1cc(nc2c1cccc2)c1cccs1

STK595420
Synonyms: 3'-(2,3-dimethylphenyl)-6'-hydroxy-2,4-dimethyl-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1cccc(c1C)C)O)[N+](=O)[O-]

STK595422
Synonyms: 1-[2-(dimethylamino)ethyl]-3-(4-fluorophenyl)-1,5,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: CN(CCn1c2sc3c(c2c(=O)n(c1=O)c1ccc(cc1)F)CCCCC3)C

STK595423
Synonyms: methylN-{[4-(propan-2-yl)phenyl]carbamoyl}-D-alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc(cc1)C(C)C)C

STK595424
Synonyms: 3-(1H-benzimidazol-2-yl)-N-benzyl-N-methylpropanamide
Smiles: O=C(N(Cc1ccccc1)C)CCc1nc2c([nH]1)cccc2

STK595426
Synonyms: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2-nitrophenyl)-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCN(CC1)c1cccc(c1)Cl)c1ccccc1[N+](=O)[O-]

STK595427
Synonyms: ethyl2-({(E)-[2-(2,4-dimethylphenyl)-1,3-dioxo-2,3-dihydroisoquinolin-4(1H)-ylidene]methyl}amino)-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C/2\c3ccccc3C(=O)N(C2=O)c2ccc(cc2C)C)sc(c1C)C

STK595428
Synonyms: 2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(naphthalen-2-yl)ethanone
Smiles: O=C(c1ccc2c(c1)cccc2)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK595430
Synonyms: N-(2-fluorophenyl)-2-{[4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2F)nnc1c1cccc(c1)C

STK595431
Synonyms: 4-({(2'S,3S,3'S,10b'R)-2'-[(2,5-dimethoxyphenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl}carbonyl)phenylacetate
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC(=O)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)OC

STK595433
Synonyms: 2-{[10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccccc1C)nn2)CC(OC3)(C)C

STK595435
Synonyms: 7-(4-methoxyphenyl)-3-(3-nitrophenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: COc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1cccc(c1)[N+](=O)[O-]

STK595436
Synonyms: (5E)-1-(3-chlorophenyl)-5-[(1-ethyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCn1cc(c2c1cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)Cl)S

STK595439
Synonyms: (5E)-1-ethyl-5-[(2-phenyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=NC(=O)/C(=C\c2c([nH]c3c2cccc3)c2ccccc2)/C1=O)S

STK595441
Synonyms: 8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cccc(c1)N1CCN(CC1)Cc1nc2c(n1CCc1ccccc1)c(=O)n(c(=O)n2C)C

STK595443
Synonyms: N-(5-chloro-2-methylphenyl)-2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(Cl)ccc2C)nnc1COc1ccc(cc1)Cl

STK595445
Synonyms: 2-{[4-amino-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK595446
Synonyms: 2-ethyl-3-(4-methoxybenzyl)-10-methylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCc1nc2c(c(=O)n1Cc1ccc(cc1)OC)c(=O)c1c(n2C)cccc1

STK595449
Synonyms: N-[3-(dimethylamino)propyl]-11-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
Smiles: CN(CCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2)C

STK595450
Synonyms: N-[5-(4-chlorophenyl)-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]butanamide
Smiles: CCCC(=O)Nc1nn2c(=NC(=CC2c2ccccc2)c2ccc(cc2)Cl)[nH]1

STK595451
Synonyms: 4-[(2E)-2-(2,4,5-trimethoxybenzylidene)hydrazinyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: COc1cc(OC)c(cc1/C=N/Nc1ncnc2c1c1CCCCc1s2)OC

STK595452
Synonyms: 3-[(2-chloro-6-fluorobenzyl)sulfanyl]-4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazole
Smiles: CCn1c(SCc2c(F)cccc2Cl)nnc1c1ccc(cc1)C

STK595453
Synonyms: 1'-benzyl-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: OC1=NC(=O)C2(C(=O)N1Cc1ccccc1)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C

STK595454
Synonyms: 7-butyl-8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCn1c(CN2CCN(CC2)c2ccc(cc2)OC)nc2c1c(=O)n(c(=O)n2C)C

STK595456
Synonyms: 8-hydrazinyl-6-hydroxy-7-(2-hydroxy-2-phenylethyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: NNc1nc2c(n1CC(c1ccccc1)O)c(O)nc(=O)n2C

STK595457
Synonyms: 3-(4-methoxyphenyl)-2-{[2-(morpholin-4-yl)ethyl]amino}-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COc1ccc(cc1)n1c(NCCN2CCOCC2)nc2c(c1=O)c1CCCCCc1s2

STK595458
Synonyms: 2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-1-yl(4,5,6-trimethoxy-1H-indol-2-yl)methanone
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)N1CCn2c1nc1c2cccc1

STK595459
Synonyms: (8S,8aR,11aS)-10-(3,5-dichlorophenyl)-8-[(2,5-dimethoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(c(c1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl)cccc3)OC

STK595460
Synonyms: 9-phenyl-2-(prop-2-en-1-ylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: C=CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1ccccc1

STK595461
Synonyms: (4E)-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: Oc1cccc(c1)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK595463
Synonyms: 4-{[(E)-(2-hydroxynaphthalen-1-yl)methylidene]amino}-5-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1/N=C/c1c(O)ccc2c1cccc2)c1cccnc1

STK595464
Synonyms: 4-{(Z)-[2-(2-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-chloro-6-methoxyphenylacetate
Smiles: COc1cc(/C=C/2\N=C(OC2=O)c2ccccc2Br)cc(c1OC(=O)C)Cl

STK595465
Synonyms: 2-({5-thioxo-4-[2-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)phthalazin-1(2H)-one
Smiles: S=c1[nH]nc(n1c1ccccc1C(F)(F)F)Cn1ncc2c(c1=O)cccc2

STK595467
Synonyms: 7-(4-acetylphenyl)-3-(3-nitrophenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: O=C1CC2(C(=O)N1c1ccc(cc1)C(=O)C)ON=C(C2)c1cccc(c1)[N+](=O)[O-]

STK595468
Synonyms: 4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-ylN-[(4-methylphenyl)sulfonyl]norleucinate
Smiles: CCCCC(C(=O)Oc1ccc2c(c1C)oc(=O)c1c2CCCC1)NS(=O)(=O)c1ccc(cc1)C

STK595469
Synonyms: 1'-benzyl-3,9-dimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[benzo[g]pyrido[1,2-a][1,8]naphthyridine-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CC1CCN2C(C1)C1(Cc3c2nc2ccc(cc2c3)C)C(=O)NC(=O)N(C1=O)Cc1ccccc1

STK595471
Synonyms: 2-[(2E)-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)hydrazinylidene]-2,3-dihydro-1H-benzimidazole
Smiles: FC(c1cccc(c1)c1ccc(o1)/C=N/N=c/1\[nH]c2c([nH]1)cccc2)(F)F

STK595472
Synonyms: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-N-phenylacetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1ccccc1

STK595473
Synonyms: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(2,5-diethoxyphenyl)acetamide
Smiles: CCOc1ccc(c(c1)NC(=O)CSc1nc2c([nH]1)cccc2)OCC

STK595476
Synonyms: 3-(3-bromophenyl)-N-(1-methoxypropan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Smiles: COCC(NC(=O)C1ON=C(C1)c1cccc(c1)Br)C

STK595477
Synonyms: 1-(3-ethoxyphenyl)-7-methyl-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cccc(c1)C1N(c2sc3c(n2)ccc(c3)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK595478
Synonyms: 1-(4-ethoxyphenyl)-2-(6-fluoro-1,3-benzothiazol-2-yl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK595479
Synonyms: 3-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-1,2,3-benzotriazin-4(3H)-one
Smiles: O=C(N1CCN(CC1)Cc1ccccc1)CCn1nnc2c(c1=O)cccc2

STK595480
Synonyms: 1-{[7-(2-amino-2-oxoethyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperidine-4-carboxamide
Smiles: NC(=O)Cn1c(CN2CCC(CC2)C(=O)N)nc2c1c(=O)n(c(=O)n2C)C

STK595481
Synonyms: 7-(4-chlorophenoxy)-6-ethyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Smiles: CCc1c(Oc2ccc(cc2)Cl)nc2n(c1=O)CCS2

STK595482
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(furan-2-ylmethyl)-5-(2-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccccc1C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1Cc1ccco1

STK595484
Synonyms: 6-cyclohexyl-2-hydroxy-1-(3-methylphenyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Cc1cccc(c1)n1c(O)nc(=O)c2c1NCN(C2)C1CCCCC1

STK595485
Synonyms: 4-{[(E)-(3-methylphenyl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)C)C

STK595486
Synonyms: N-[4-(benzyloxy)phenyl]-2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK595487
Synonyms: 2-(3,4-dimethoxyphenyl)-5H-imidazo[2,1-a]isoindole
Smiles: COc1cc(ccc1OC)c1cn2c(n1)c1c(C2)cccc1

STK595491
Synonyms: N-[(6-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methoxyphenyl)-4-methylbenzenesulfonamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccc(cc1)C)c1ccccc1OC

STK595492
Synonyms: 1-[2-(morpholin-4-yl)ethyl]-3-(2-phenylethyl)-1,5,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: O=c1n(CCc2ccccc2)c(=O)c2c(n1CCN1CCOCC1)sc1c2CCCCC1

STK595493
Synonyms: N-{[(3S)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]carbonyl}glycine
Smiles: OC(=O)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK595494
Synonyms: N-(4-bromo-3-methylphenyl)-2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)Br)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK595495
Synonyms: 5-(4-ethoxyphenyl)-4-{[(E)-(4-propoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)OCC

STK595496
Synonyms: N'-[(1E)-1-(furan-2-yl)ethylidene]-4,5-dihydro-2H-benzo[g]indazole-3-carbohydrazide
Smiles: C/C(=N\NC(=O)c1[nH]nc2c1CCc1c2cccc1)/c1ccco1

STK595498
Synonyms: (3a'S,6a'R)-5'-[2-(3,4-dimethoxyphenyl)ethyl]-5-fluoro-3'-(1-hydroxyethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3C(O)C)C(=O)Nc3c2cc(F)cc3)ccc1OC

STK595499
Synonyms: 2-{[8,8-dimethyl-11-(morpholin-4-yl)-7,10-dihydro-8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nnc2n1cnc1c2sc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK595501
Synonyms: 5-{[1-(2-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1N(C)C(=O)C(=Cc2cc(n(c2C)c2ccccc2O)C)C(=O)N1C

STK595503
Synonyms: 5-[3-(propan-2-yloxy)phenyl]-4-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1c(OC)cc(cc1OC)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC(C)C

STK595505
Synonyms: (2'S,3S,3'S,10b'R)-2'-[(3-methoxyphenyl)carbonyl]-3'-[(3-nitrophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2cccc(c2)[N+](=O)[O-])N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK595507
Synonyms: 10-(4-hydroxy-3,5-dimethoxyphenyl)-1,3-dimethyl-5-phenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: COc1cc(cc(c1O)OC)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C

STK595509
Synonyms: 3-(3-methoxypropyl)-2-(2-methylphenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccccc1C

STK595510
Synonyms: N-[(1Z)-1-{1-cyano-2-[(4-methylbenzyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]-4-nitrobenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)[N+](=O)[O-])/C(=O)NCc1ccc(cc1)C

STK595511
Synonyms: 7-bromo-2-(4-methylpyridin-2-yl)-1-phenyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Brc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1)c1nccc(c1)C

STK595512
Synonyms: (2E)-3-(3,5-dichloro-4-hydroxyphenyl)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1cc(Cl)c(c(c1)Cl)O)/c1scc(n1)c1ccc(c(c1)OC)OC

STK595513
Synonyms: 2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccccc2)c2ccc(cc2)C(C)(C)C)cc(c1)OC

STK595514
Synonyms: 5-(2-chlorophenyl)-4-{[(E)-(2-methoxynaphthalen-1-yl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc2c(c1/C=N/n1c(=S)[nH]nc1c1ccccc1Cl)cccc2

STK595515
Synonyms: 4-{[(E)-(3-chlorophenyl)methylidene]amino}-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cccc(c1)/C=N/n1c(COc2ccccc2)n[nH]c1=S

STK595516
Synonyms: 12-(furan-2-yl)-3-phenyl-2,3,4,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1-ol
Smiles: OC1=C2C(=Nc3n(C2c2ccco2)c2ccccc2n3)CC(C1)c1ccccc1

STK595517
Synonyms: (4Z)-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-4-[(4-methylphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: Cc1ccc(cc1)/N=c/1\nc(N)nc([nH]1)CN1CCN(CC1)c1ccccc1F

STK595518
Synonyms: 7-(3,4-dichlorobenzyl)-1,3-dimethyl-8-(piperidin-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1Cl)Cn1c(CN2CCCCC2)nc2c1c(=O)n(C)c(=O)n2C

STK595520
Synonyms: 4-[(2E)-2-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}hydrazinyl]benzoicacid
Smiles: Clc1ccc(c(c1)c1ccc(o1)/C=N/Nc1ccc(cc1)C(=O)O)Cl

STK595521
Synonyms: S-benzyl-N-[3-(5-methyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanoyl]-D-cysteine
Smiles: O=C(N[C@@H](C(=O)O)CSCc1ccccc1)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1

STK595522
Synonyms: 10-methyl-2-(4-nitrophenyl)-3-propylpyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccc(cc1)[N+](=O)[O-]

STK595523
Synonyms: 4-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(=S)[nH]nc1c1ccccn1

STK595527
Synonyms: N-[4-(dimethylamino)phenyl]-2-{[4-methyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)N(C)C)CSc1nnc(n1C)c1ccc(cc1)C

STK595528
Synonyms: 4-bromo-N-[(3E)-1-ethyl-7-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide
Smiles: CCn1[nH]/c(=N/S(=O)(=O)c2ccc(cc2)Br)/c2c1nc1cc(C)ccc1c2

STK595530
Synonyms: (4E)-5-(2-fluorophenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
Smiles: CSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2cccs2)/O)/C1c1ccccc1F

STK595533
Synonyms: (3a'S,6a'R)-3'-benzyl-5-chloro-5'-(2-methoxyethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccccc2)C(=O)Nc2c1cc(Cl)cc2

STK595534
Synonyms: 11-(4-butylphenyl)-2-methyl-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)CCC(C)C

STK595535
Synonyms: 2-({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-ethylphenyl)acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)OC

STK595536
Synonyms: 7-(3-chlorophenyl)-3-(3-nitrophenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: Clc1cccc(c1)N1C(=O)CC2(C1=O)ON=C(C2)c1cccc(c1)[N+](=O)[O-]

STK595537
Synonyms: 2-(ethylsulfanyl)-6,6-dimethyl-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CC(C1)(C)C)C2c1ccccc1

STK595539
Synonyms: 2-{[2-(2-hydroxyethoxy)ethyl]amino}-3-(2-phenylethyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: OCCOCCNc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CCCCC3

STK595540
Synonyms: 5-(3,4-dimethoxyphenyl)-4-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1OC)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)C

STK595541
Synonyms: N-(3,4-difluorophenyl)-2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)Nc1ccc(c(c1)F)F

STK595543
Synonyms: 2-methyl-5-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1nn2c(n1)nc(cc2O)CSc1nnnn1c1ccccc1

STK595544
Synonyms: 2-(methylsulfanyl)-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-ol
Smiles: CSc1nc2n(n1)c(O)c1c(n2)CCC1

STK595545
Synonyms: 2-(4-chlorophenyl)-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc(OC)c(c1)OC)c1ccc(cc1)Cl

STK595546
Synonyms: 7-chloro-2-(5-methyl-1,2-oxazol-3-yl)-1-[3-(propan-2-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CC(Oc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl)C

STK595547
Synonyms: tert-butyl{(2S)-1-oxo-1-[(2E)-2-(quinoxalin-5-ylmethylidene)hydrazinyl]propan-2-yl}carbamate(non-preferredname)
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)N/N=C/c1cccc2c1nccn2)C

STK595548
Synonyms: N-[3-(4-fluorophenyl)-4-oxo-4H-thiochromen-2-yl]-2-phenylacetamide
Smiles: O=C(Nc1sc2ccccc2c(=O)c1c1ccc(cc1)F)Cc1ccccc1

STK595549
Synonyms: 2-{[4-ethyl-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2cccc(c2)F)nnc1Cc1cccs1

STK595550
Synonyms: (3a'S,6a'R)-5-bromo-5'-(butan-2-yl)-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(CC)C)C(=O)Nc1c2cc(Br)cc1

STK595553
Synonyms: 2-{2-amino-3-[(3-chlorophenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-1-yl}ethanol
Smiles: OCCn1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1cccc(c1)Cl

STK595554
Synonyms: 6,7-dimethoxy-3-({4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}amino)-2-benzofuran-1(3H)-one
Smiles: COc1c(OC)ccc2c1C(=O)OC2Nc1scc(n1)c1ccc(cc1)CC(C)C

STK595556
Synonyms: 1-(2,3-dimethoxyphenyl)-2-(6-ethoxy-1,3-benzothiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1OC)OC)c(=O)c1c(o2)cccc1

STK595558
Synonyms: N-[4-(butan-2-yl)phenyl]-2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(CC)C)nnc1c1cccc(c1)OC

STK595559
Synonyms: 4-[(2E)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)hydrazinyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N/N=C/c1ccc2c(c1)OCCO2

STK595561
Synonyms: 3-(3-chlorophenyl)-7-methyl-2-[(pyridin-3-ylmethyl)amino]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c(n1)NCc1cccnc1)c1cccc(c1)Cl

STK595562
Synonyms: (2Z)-2-(4-chlorophenyl)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-phenylprop-2-en-1-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)/C(=C\c1ccccc1)/c1ccc(cc1)Cl

STK595564
Synonyms: 1,7,8-trimethyl-3-(naphthalen-1-ylmethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: O=c1n(Cc2cccc3c2cccc3)c(=O)c2c(n1C)nc1n2cc(n1C)C

STK595565
Synonyms: N-[3-(2-chlorophenyl)-1-ethyl-4-oxo-1,4-dihydroquinolin-2-yl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1n(CC)c2ccccc2c(=O)c1c1ccccc1Cl

STK595568
Synonyms: (4E)-1-(furan-2-ylmethyl)-4-[hydroxy(3-nitrophenyl)methylidene]-5-(2-nitrophenyl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccccc1[N+](=O)[O-])Cc1ccco1)/c1cccc(c1)[N+](=O)[O-]

STK595569
Synonyms: 2-{[7,7-dimethyl-2-(3-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C

STK595570
Synonyms: 4-{[(E)-(2-methylphenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccccc1C

STK595571
Synonyms: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[3-(quinolin-2-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]benzenesulfonamide
Smiles: CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)n1c(=S)[nH]nc1c1ccc2c(n1)cccc2

STK595572
Synonyms: (5s,7s)-2-(3-bromophenyl)-5-ethyl-7-methyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1cccc(c1)Br)C

STK595576
Synonyms: (5E)-2-[4-(4-chlorophenyl)piperazin-1-yl]-5-[(5-phenylfuran-2-yl)methylidene]-1,3-thiazol-4(5H)-one
Smiles: Clc1ccc(cc1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(o2)c2ccccc2)/S1

STK595578
Synonyms: 2-[(3a'S,6a'R)-5-chloro-5'-(4-fluorobenzyl)-7-methyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Smiles: NC(=O)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccc(cc1)F)C(=O)Nc1c2cc(Cl)cc1C

STK595580
Synonyms: N-[(2Z)-3-(3-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]tetrahydrofuran-2-carboxamide
Smiles: COc1cccc(c1)CN1/C(=N/C(=O)C2CCCO2)/SC2C1CS(=O)(=O)C2

STK595581
Synonyms: 2-({6-cyano-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
Smiles: N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccc(cc1)C)c(SCC(=O)Nc1cccc(c1)C)nn2

STK595582
Synonyms: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Smiles: CC(CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C)C

STK595583
Synonyms: quinolin-8-yl3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylate
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)Oc1cccc2c1nccc2

STK595585
Synonyms: 3-butyl-5-[(2E)-3-(2,4-dimethoxyphenyl)prop-2-enoyl]-2,6-dihydroxypyrimidin-4(3H)-one
Smiles: CCCCn1c(O)nc(c(c1=O)C(=O)/C=C/c1ccc(cc1OC)OC)O

STK595587
Synonyms: (E)-{2-(3-butoxyphenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Smiles: CCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

STK595588
Synonyms: (E)-(4-fluorophenyl){2-(4-hydroxy-3-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1cc(ccc1O)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)F)/[O-]

STK595589
Synonyms: (8S,8aR,11aS)-N-(4-methoxyphenyl)-10-(4-methylphenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)C)cccc3

STK595590
Synonyms: 1-hydroxy-9-oxo-9H-xanthen-3-ylN-[(4-methylphenyl)sulfonyl]-D-leucinate
Smiles: CC(C[C@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1)NS(=O)(=O)c1ccc(cc1)C)C

STK595592
Synonyms: (2Z)-7-{[bis(2-methoxyethyl)ammonio]methyl}-2-(2,5-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cc(OC)ccc1OC)/C2=O)CCOC

STK595593
Synonyms: 4-(3-bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-ol
Smiles: CCOc1ccc(cc1Br)C1NC(=NC2=C1CCc1c2cccc1)O

STK595594
Synonyms: (4E)-2-(2,4-dimethylphenyl)-4-{[(6-methylpyridin-2-yl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: Cc1cccc(n1)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1C)C

STK595595
Synonyms: 2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl)C

STK595596
Synonyms: 2',6'-dihydroxy-3-methyl-8-nitro-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidin]-4'-one
Smiles: CC1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=NC(=NC1=O)O)O

STK595597
Synonyms: 4-(4-fluorophenyl)-5-(quinolin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)n1c(=S)[nH]nc1c1ccc2c(n1)cccc2

STK595599
Synonyms: N-(furan-2-ylmethyl)-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline-8(7H)-carbothioamide
Smiles: S=C(N1CCc2c(C1)cc1c(c2)OCCCO1)NCc1ccco1

STK595600
Synonyms: 8-(3,4-dimethylphenyl)-4-hydroxy-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: Cc1ccc(cc1C)n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK595601
Synonyms: 10-(2-methoxyphenyl)-5-(4-methoxyphenyl)-1,3-dimethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: COc1ccc(cc1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1ccccc1OC

STK595602
Synonyms: 2-{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N,N-dimethylethanamine
Smiles: COc1ccc(cc1)c1nc(SCCN(C)C)c2c(n1)CC(OC2)(C)C

STK595603
Synonyms: 1-(2-cyclohexylethyl)-2-[(naphthalen-2-yloxy)methyl]-1H-benzimidazole
Smiles: C1CCC(CC1)CCn1c(COc2ccc3c(c2)cccc3)nc2c1cccc2

STK595606
Synonyms: (2Z)-1-(3-chlorophenyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Smiles: Clc1cccc(c1)C(=O)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK595607
Synonyms: 1-(2,4-dimethylphenyl)-3-{4-hydroxy-6-[(pyridin-2-ylsulfanyl)methyl]pyrimidin-2-yl}guanidine
Smiles: Oc1nc(nc(c1)CSc1ccccn1)NC(=N)Nc1ccc(cc1C)C

STK595608
Synonyms: N-(2-tert-butylphenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1COc1ccc(cc1)C

STK595609
Synonyms: (4E)-4-{[(3-methylbutyl)amino]methylidene}-2-(2-nitrophenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: CC(CCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccccc1[N+](=O)[O-])C

STK595610
Synonyms: N-[4-(acetylamino)phenyl]-2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nnc1c1ccccc1Cl

STK595612
Synonyms: 3-[(2,6-dichlorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCc1c(Cl)cccc1Cl

STK595613
Synonyms: N-[3-(dimethylamino)propyl]-5-methoxy-3-methyl-1H-indole-2-carboxamide
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)NCCCN(C)C

STK595615
Synonyms: (6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)(2,3-dimethylphenyl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1cccc(c1C)C

STK595618
Synonyms: 2-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-(pyridin-3-ylmethyl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)NCc1cccnc1

STK595619
Synonyms: 2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2OC)nnc1COc1ccccc1

STK595620
Synonyms: 2-({5-[(4-chlorophenoxy)methyl]-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethylphenyl)acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK595624
Synonyms: (3a'S,6a'R)-5'-(3-chlorophenyl)-5-fluoro-3'-(4-hydroxybenzyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1cccc(c1)Cl)Cc1ccc(cc1)O)C(=O)N2

STK595625
Synonyms: 8-[(4-benzylpiperidin-1-yl)methyl]-7-(3-chlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cccc(c1)Cn1c(CN2CCC(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK595626
Synonyms: (8S,8aR,11aS)-10-cyclohexyl-8-[(2,5-dimethoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1C=Cc1c2cccc1)C1CCCCC1)OC

STK595627
Synonyms: N-(2,6-dimethylphenyl)-2-{[4-(4-methoxyphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nnc1c1ccccn1

STK595629
Synonyms: (3S,3a'R,8a'S,8b'S)-2'-(3-chlorophenyl)-5-ethyl-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: CCc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)Cl

STK595631
Synonyms: 2-{[4-(4-chlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK595632
Synonyms: 2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK595633
Synonyms: 4-{[(E)-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1c(OC)cc(cc1OC)c1n[nH]c(=S)n1/N=C/c1c(C)nn(c1C)c1ccccc1

STK595635
Synonyms: 4-(4-ethoxyphenyl)-3-(4-methoxyphenyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Smiles: CCOc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1c1ccc(cc1)OC

STK595636
Synonyms: 1-(4-fluorophenyl)-6-(3-phenylpropyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Fc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)CCCc1ccccc1

STK595638
Synonyms: 7-benzyl-6,10-dimethyl-3-[2-(morpholin-4-yl)ethyl]-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c(c1Cc1ccccc1)C)CCN1CCOCC1

STK595639
Synonyms: 2-[(2-chlorobenzyl)sulfanyl]-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: COc1cc(cc(c1OC)OC)C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1ccccc1Cl

STK595648
Synonyms: N-(3-bromophenyl)-2-{[4-(4-chlorophenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)Br)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK595649
Synonyms: (3a'S,6a'R)-5'-tert-butyl-5-chloro-3'-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Clc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C(C)(C)C)C)C(=O)N2

STK595651
Synonyms: (2E)-3-(4-chlorophenyl)-1-(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)prop-2-en-1-one
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)/C=C/c1ccc(cc1)Cl

STK595652
Synonyms: 8-[(2E)-2-(2,4-dihydroxybenzylidene)hydrazinyl]-7-(4-fluorobenzyl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Fc1ccc(cc1)Cn1c(N/N=C/c2ccc(cc2O)O)nc2c1c(O)nc(=O)n2C

STK595653
Synonyms: (4-chloro-3-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}phenyl)(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc(c(c1)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)F)Cl

STK595654
Synonyms: 2-{[5-(3-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK595657
Synonyms: 4-chloro-5-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]pyridazin-3-ol
Smiles: Fc1ccc(cc1)/C=N/Nc1cnnc(c1Cl)O

STK595658
Synonyms: (4E)-1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-5-(3-chlorophenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: Clc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C

STK595659
Synonyms: N-[4-({(E)-[4,6-dioxo-2-sulfanyl-1-(3,4,5-trimethoxyphenyl)-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}amino)phenyl]acetamide
Smiles: COc1c(OC)cc(cc1OC)N1C(=NC(=O)/C(=C\Nc2ccc(cc2)NC(=O)C)/C1=O)S

STK595660
Synonyms: 4-methoxy-N-[6-methyl-2,4-bis(4-methylphenyl)-5-oxo-2,5-dihydropyridazin-3-yl]benzamide
Smiles: COc1ccc(cc1)C(=O)Nc1c(c2ccc(cc2)C)c(=O)c(nn1c1ccc(cc1)C)C

STK595661
Synonyms: 6-benzyl-1-phenyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Sc1nc(=O)c2c(n1c1ccccc1)NCN(C2)Cc1ccccc1

STK595662
Synonyms: (5-chloro-1H-indol-2-yl)[4-(furan-2-ylcarbonyl)piperazin-1-yl]methanone
Smiles: Clc1ccc2c(c1)cc([nH]2)C(=O)N1CCN(CC1)C(=O)c1ccco1

STK595663
Synonyms: N-(3-chloro-4-fluorophenyl)-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CCCn1cnc2c(c1=O)cccc2

STK595664
Synonyms: N-(2-tert-butylphenyl)-2-{[5-(3-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C(C)(C)C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK595665
Synonyms: 9,10-dimethoxy-3,3-dimethyl-13-(3-nitrophenyl)-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one
Smiles: COc1cc2CCN3C(=CC(C4=C3CC(C)(C)CC4=O)c3cccc(c3)[N+](=O)[O-])c2cc1OC

STK595666
Synonyms: 2-{[5-(2-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1CC)c1ccccc1Cl

STK595670
Synonyms: 3-(3-methoxyphenyl)-4-(4-methoxyphenyl)-5-[(2-methylbenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(nnc1c1cccc(c1)OC)SCc1ccccc1C

STK595671
Synonyms: 6-{[(4-chlorophenyl)sulfanyl]methyl}-2-[(4,6,8-trimethylquinazolin-2-yl)amino]pyrimidin-4-ol
Smiles: Cc1cc(C)c2c(c1)c(C)nc(n2)Nc1nc(CSc2ccc(cc2)Cl)cc(n1)O

STK595673
Synonyms: 2-[7-(2,5-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Smiles: Cc1ccc(c(c1)n1ncc2c1ncn1c2nc(n1)c1ccccc1O)C

STK595676
Synonyms: (5E)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]propylidene}-3-benzyl-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O)/NCc1ccc2c(c1)OCO2

STK595678
Synonyms: 2-chloro-N-[1-methyl-4-oxo-3-(pyridin-2-yl)-1,4-dihydroquinolin-2-yl]benzamide
Smiles: Clc1ccccc1C(=O)Nc1c(c2ccccn2)c(=O)c2c(n1C)cccc2

STK595679
Synonyms: 5-tert-butyl-N,3-diphenylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CC(c1cc(Nc2ccccc2)n2c(n1)c(cn2)c1ccccc1)(C)C

STK595680
Synonyms: 1-{3-[(2-chlorobenzyl)oxy]phenyl}-7-methyl-2-(5-methyl-1,2-oxazol-3-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1cccc(c1)OCc1ccccc1Cl)c1noc(c1)C

STK595681
Synonyms: (5s,7s)-5-methyl-2-(3-methylphenyl)-7-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: Cc1cccc(c1)C1N2C[C@@]3(CN1C[C@](C2)(C3=O)c1ccccc1)C

STK595682
Synonyms: 7,7-dimethyl-2-phenyl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-2H-pyrazolo[3,4-b]quinoline-3,5-diol
Smiles: OC1=C2C(=Nc3c(C2c2ccc(cc2)C(F)(F)F)c(O)n(n3)c2ccccc2)CC(C1)(C)C

STK595683
Synonyms: N'-[(E)-(6-hydroxy[1,3]dioxolo[4,5-g]quinolin-7-yl)methylidene]pyridine-4-carbohydrazide
Smiles: Oc1nc2cc3OCOc3cc2cc1/C=N/NC(=O)c1ccncc1

STK595685
Synonyms: N-[(3E)-1-butyl-7-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-fluorobenzenesulfonamide
Smiles: CCCCn1[nH]/c(=N/S(=O)(=O)c2ccc(cc2)F)/c2c1nc1cc(C)ccc1c2

STK595686
Synonyms: 2-[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
Smiles: O=C(COc1ccc2c(c1C)oc(=O)c1c2CCCC1)NCCCN1CCCC1=O

STK595687
Synonyms: N-[(2S)-1-(cyclohexylamino)-1-oxo-3-phenylpropan-2-yl]-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: O=C([C@@H](NC(=O)N1CCn2c1nc1c2cccc1)Cc1ccccc1)NC1CCCCC1

STK595688
Synonyms: 6,7-dimethoxy-2-[4-(morpholin-4-ylsulfonyl)-2-nitrophenyl]-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CN(CCc2cc1OC)c1ccc(cc1[N+](=O)[O-])S(=O)(=O)N1CCOCC1

STK595689
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-cyclohexylmethylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1CN(c1ccccc1)C)c1nonc1N)N/N=C/C1CCCCC1

STK595691
Synonyms: 8-(4-ethylpiperazin-1-yl)-1,3-dimethyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1CCc1ccccc1)c(=O)n(c(=O)n2C)C

STK595695
Synonyms: 1-{N-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoyl]glycylglycyl}-4-phenylpiperidine-4-carboxylicacid
Smiles: O=C(NCC(=O)N1CCC(CC1)(C(=O)O)c1ccccc1)CNC(=O)CCc1c(=O)oc2c(c1C)ccc(c2C)O

STK595697
Synonyms: 1'-pentyl-15,16-dihydro-2'H,4bH,6H,7H-spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1-a]isoquinoline-5,5'-pyrimidine]-2',4',6',7(1'H,3'H)-tetrone
Smiles: CCCCCN1C(=O)NC(=O)C2(C1=O)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2

STK595698
Synonyms: 2-[(12,12-dimethyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C

STK595699
Synonyms: methylN-[(2,4-dimethylphenyl)carbamoyl]-D-alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc(cc1C)C)C

STK595701
Synonyms: N-cyclooctyl-3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanamide
Smiles: O=C(NC1CCCCCCC1)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK595702
Synonyms: 4-(propan-2-yl)-N-(pyridin-3-ylmethyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-7-amine
Smiles: CC(c1nc2oc3c(c2c2c1CCC2)ncnc3NCc1cccnc1)C

STK595703
Synonyms: 4-{3-[(E)-(2-cyclopropyl-5-iminio-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}phenolate
Smiles: [O-]c1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=[NH2+])nc(s2)C1CC1

STK595704
Synonyms: 3-butyl-6-hydroxy-1'-methyl-6'-nitro-2'-phenyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: CCCCN1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N(C2c1ccccc1)C)[N+](=O)[O-])O

STK595706
Synonyms: 3-(3-chlorophenyl)-10-methyl-2-(2-methylphenyl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: Clc1cccc(c1)n1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccccc1C

STK595707
Synonyms: 1'-butyl-6-hydroxy-3-(3-methoxyphenyl)-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: CCCCN1c2ccc(cc2CC2(C1CCC)C(=NC(=O)N(C2=O)c1cccc(c1)OC)O)[N+](=O)[O-]

STK595709
Synonyms: N-[(3Z)-1-ethyl-6-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-fluorobenzenesulfonamide
Smiles: CCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)F)/c2c1nc1ccc(cc1c2)C

STK595710
Synonyms: N'-[(E)-(6-hydroxy[1,3]dioxolo[4,5-g]quinolin-7-yl)methylidene]-4-methylbenzenesulfonohydrazide
Smiles: Cc1ccc(cc1)S(=O)(=O)N/N=C/c1cc2cc3OCOc3cc2nc1O

STK595711
Synonyms: N-(3-chlorophenyl)-2-[(1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-yl)oxy]acetamide
Smiles: O=C(Nc1cccc(c1)Cl)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK595712
Synonyms: N-(3-methoxyphenyl)-2-[(2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: COc1cccc(c1)NC(=O)COc1ccc2c(c1)oc(=O)cc2

STK595713
Synonyms: N-(3-chlorophenyl)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexanecarboxamide
Smiles: Clc1cccc(c1)NC(=O)C1CCC(CC1)Cn1cnc2c(c1=O)cccc2

STK595714
Synonyms: 1-(3-chlorophenyl)-4-(2,3,4-trimethoxyphenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1ccc(c(c1OC)OC)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)Cl

STK595715
Synonyms: (1S,2S)-N'-{(E)-[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}-2-phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1ccc(o1)c1cc(Cl)ccc1Cl

STK595717
Synonyms: 10-methyl-6-propyl-3-(tetrahydrofuran-2-ylmethyl)-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: CCCc1cc(=O)oc2c1cc1CN(COc1c2C)CC1CCCO1

STK595718
Synonyms: 10-(3-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Oc1cccc(c1)C1OCC(n2c1c1c(c2c2cccc(c2)[N+](=O)[O-])c(=O)n(c(=O)n1C)C)(C)C

STK595720
Synonyms: (5E)-3-(4-chlorophenyl)-6-hydroxy-5-[1-(morpholin-4-ylamino)propylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/NN1CCOCC1

STK595721
Synonyms: 4-{[(E)-(4-ethoxyphenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccn1

STK595722
Synonyms: 2-(2-methoxyphenyl)-5,10,10-trimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2

STK595725
Synonyms: 8-(4-chlorophenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Smiles: Clc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK595726
Synonyms: 2-({4-(4-ethoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-methoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2OC)nnc1COc1ccc(cc1)C

STK595727
Synonyms: N-[4-(butan-2-yl)phenyl]-2-{[5-(3-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl)C

STK595728
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylicacid
Smiles: Cc1cc(C)nc(n1)SCc1c(nnn1c1nonc1N)C(=O)O

STK595729
Synonyms: 2-(6-methoxy-1,3-benzothiazol-2-yl)-1-(3-methoxyphenyl)-7-methyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)OC)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK595730
Synonyms: 6,6-dimethyl-9-(4-methylphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nc2n(n1)C(c1ccc(cc1)C)C1=C(O)CC(CC1=N2)(C)C

STK595733
Synonyms: (5E)-5-[(1-butyl-2,3-dihydro-1H-indol-5-yl)methylidene]-3-hexyl-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCCCCCN1C(=O)N=C(/C(=C\c2ccc3c(c2)CCN3CCCC)/C1=O)O

STK595734
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(2,4-dihydroxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Oc1ccc(c(c1)O)c1n[nH]c(=S)n1c1ccc2c(c1)OCCO2

STK595735
Synonyms: methylN-{(1E)-1-[4-hydroxy-1-(2-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]propyl}tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/CC

STK595736
Synonyms: (3a'S,6a'R)-7-chloro-5'-(2-phenylethyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC(C1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cccc1Cl)C

STK595737
Synonyms: N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-3-(1H-indol-3-yl)propanamide
Smiles: O=C(CCc1c[nH]c2c1cccc2)NCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK595738
Synonyms: 7-hydrazinyl-3,5-diphenylpyrazolo[1,5-a]pyrimidine
Smiles: NNc1cc(nc2n1ncc2c1ccccc1)c1ccccc1

STK595739
Synonyms: N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylpropyl)methanesulfonamide
Smiles: CC(CN(S(=O)(=O)C)Cc1cc2cc(C)ccc2[nH]c1=O)C

STK595740
Synonyms: (4E)-5-(3-ethoxyphenyl)-4-[furan-2-yl(hydroxy)methylidene]-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
Smiles: CCOc1cccc(c1)C1/C(=C(/c2ccco2)\O)/C(=O)C(=O)N1c1nnc(s1)SC

STK595741
Synonyms: 3-({4-[(4-methylpiperazin-1-yl)carbonyl]cyclohexyl}methyl)-1,2,3-benzotriazin-4(3H)-one
Smiles: CN1CCN(CC1)C(=O)C1CCC(CC1)Cn1nnc2c(c1=O)cccc2

STK595742
Synonyms: N-{4-[(3a'S,6a'R)-6-chloro-3'-(1H-indol-3-ylmethyl)-7-methyl-2,4',6'-trioxo-1,2,2',3',3a',4',6',6a'-octahydro-5'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1ccc(c2C)Cl

STK595743
Synonyms: 2-(ethylsulfanyl)-9-(2-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1ccccc1C

STK595744
Synonyms: 1-(3,4-dimethoxyphenyl)-2-[6-(propan-2-yl)-1,3-benzothiazol-2-yl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(ccc1OC)C1N(c2nc3c(s2)cc(cc3)C(C)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK595746
Synonyms: 3-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-4-amine
Smiles: Clc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCc1ccc(cc1)[N+](=O)[O-]

STK595747
Synonyms: (1'S,3R,3'S,7a'S)-5''-chloro-1'-[(2-ethoxyphenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCOc1ccccc1C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(Cl)cc1

STK595748
Synonyms: (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(2,5-dimethoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccc(c(c1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)Cl)C)/C1=O)S)OC

STK595749
Synonyms: 1,4-dimethyl-2-oxo-5-{(Z)-[4-oxo-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-6-(piperidin-1-yl)-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)C(C)C)c(n(c1=O)C)N1CCCCC1

STK595750
Synonyms: 3-(4-methoxyphenyl)-7-(4-methylphenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-6,8-dione
Smiles: COc1ccc(cc1)C1=NOC2(C1)CC(=O)N(C2=O)c1ccc(cc1)C

STK595751
Synonyms: 2-chloro-7-(4-fluorophenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Fc1ccc(cc1)C1C2=C(Nc3n1ncn3)c1c(OC2)ccc(c1)Cl

STK595753
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(3,4-dimethoxyphenyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1cccc(c1)C(F)(F)F

STK595754
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxy-4-propoxyphenyl)-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK595756
Synonyms: 1',3',4a-trimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1ccccc1N1C2(C)CCCC1

STK595759
Synonyms: (2Z)-2-(3-fluorobenzylidene)-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: Fc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]

STK595761
Synonyms: 2-[(3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]-N-(propan-2-yl)acetamide
Smiles: CC(NC(=O)COc1cc(C)cc2c1c(C)c(c(=O)o2)Cc1ccccc1)C

STK595762
Synonyms: 2-methoxy-4-[(E)-{[3-(phenoxymethyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]phenylacetate
Smiles: COc1cc(ccc1OC(=O)C)/C=N/n1c(COc2ccccc2)n[nH]c1=S

STK595763
Synonyms: (2'S,3S,3'S,10b'R)-3'-[(4-chlorophenyl)carbonyl]-2'-[(2-ethoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: CCOc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK595764
Synonyms: 2-[(4-methoxyphenoxy)methyl]-11-(2-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccc(cc1)OCc1nc2n(n1)cnc1c2C(c2ccccc2OC)c2c(O1)n(nc2C)c1ccccc1

STK595767
Synonyms: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,6-dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK595768
Synonyms: (1'S,3R,3'S,7a'S)-1'-[(2-ethoxyphenyl)carbonyl]-5'',7''-dimethyl-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Smiles: CCOc1ccccc1C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(C)cc1C

STK595769
Synonyms: (4E)-2-(2,4-dimethoxyphenyl)-4-{[(2,4-dimethoxyphenyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: COc1ccc(c(c1)OC)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1OC)OC

STK595771
Synonyms: N-(3-chlorophenyl)-2-{[4-(4-methylphenyl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK595772
Synonyms: 6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-8-(prop-2-en-1-ylamino)-3,7-dihydro-2H-purin-2-one
Smiles: C=CCNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(O)nc(=O)n2C

STK595773
Synonyms: N-cyclohexyl-1-(4-ethylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: CCc1ccc(cc1)c1c(C(=O)NC2CCCCC2)n2c3c1CCCCn3c(c2)c1ccccc1

STK595774
Synonyms: N-[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl]ethane-1,2-diamine
Smiles: NCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C

STK595776
Synonyms: (4E)-5-(2-chlorophenyl)-4-[hydroxy(phenyl)methylidene]-1-(3-methylphenyl)pyrrolidine-2,3-dione
Smiles: Cc1cccc(c1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccccc1Cl

STK595777
Synonyms: 1-[8-methyl-10-phenyl-2-(thiophen-2-yl)-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: CC(=O)C1=C(C)Oc2c(C1c1ccccc1)c1nc(nn1cn2)c1cccs1

STK595778
Synonyms: 7-methyl-3-{(Z)-[4-oxo-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: Cc1ccc2n(c1)c(=O)c(c(n2)N1CCN(CC1)c1ccccc1)/C=C/1\SC(=S)N(C1=O)C(C)C

STK595779
Synonyms: N-(4-{[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl](tetrahydrofuran-2-ylmethyl)sulfamoyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)CC1CCCO1

STK595780
Synonyms: N-[3,5-bis(trifluoromethyl)phenyl]-2-{[4-ethyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)nnc1c1cccc(c1)C

STK595781
Synonyms: 3-[(Z)-(3-cyclopentyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2)/C(=O)N1C1CCCC1

STK595782
Synonyms: 3,4,5-trimethoxy-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylpropyl)benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)N(Cc1cc2cccc(c2[nH]c1=O)C)CC(C)C

STK595785
Synonyms: N-(2,5-dimethylphenyl)-2-{[5-(2-fluorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2C)nnc1c1ccccc1F