FULL DB

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

STK610843
Synonyms: 1-[(2Z)-5-[(2,4-dibromophenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-fluorophenyl)urea
Smiles: Fc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)COc1ccc(cc1Br)Br

STK610844
Synonyms: N-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]-2-[(5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-methylacetamide
Smiles: O=C(N(CC(=O)c1ccc(c(c1)O)O)C)CN1C(=S)S/C(=C\c2ccco2)/C1=O

STK586794
Synonyms:
Smiles: CCC([C@@H](C(=O)OC)NC(=O)NCCCc1ccccc1)C

STK672149
Synonyms:
Smiles: Cc1ccc(cc1)OP(=O)(Oc1ccc(cc1)C)N/N=C(\C(=O)c1ccccc1)/c1ccccc1

STK672153
Synonyms:
Smiles: Cc1ccc(cc1)OP(=O)(Oc1ccc(cc1)C)N/N=C\1/C(=O)Nc2c1cccc2

STK572256
Synonyms:
Smiles: COc1cccc(c1)CNC(=O)[C@H](C(CC)C)NC(=O)N1CCn2c1nc1c2cccc1

STK611456
Synonyms:
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1Cl)C(O)C)Cl

STK593873
Synonyms:
Smiles: CCC([C@@H](C(=O)NC1CCCC1)NC(=O)C1CC(=O)N(C1)c1ccc(cc1)OC)C

STK754446
Synonyms:
Smiles: O/N=C(/[C@H]1[C@@H](CC2[C@]1(C)CCC1C2CC=C2[C@]1(C)CC[C@@H](C2)OC(=O)C)C([N+](=O)[O-])C)\C

STK743637
Synonyms:
Smiles: O=C(Cn1[nH]nc(n1)c1cccc(c1)C(F)(F)F)Nc1ccccc1

STK743641
Synonyms:
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]n(n1)CC(=O)NCc1ccccc1

STK747419
Synonyms:
Smiles: [O-][N+](=O)c1cc(N[C@@H]2OC[C@@H](C(C2O)O)O)c(cc1)C

STK414829
Synonyms:
Smiles: O=S(=O)(c1ccccc1)NC1=CC=[C]2=CC=CC=[C]2=C1

STK801497
Synonyms:
Smiles: OC(=O)c1n[nH]cc1[N](=O)O

STK586663
Synonyms:
Smiles: CCC([C@@H](c1nnc(o1)S(=O)(=O)Cc1ccccc1Cl)NC(=O)OC(C)(C)C)C

STK610847
Synonyms: (4Z)-4-{2-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-4H-chromen-4-ylidene}-2-(thiophen-2-yl)-1,3-oxazol-5(4H)-one
Smiles: COc1ccc(cc1CN1CCOCC1)C1=C/C(=C\2/N=C(OC2=O)c2cccs2)/c2c(O1)cccc2

STK610848
Synonyms: N-[(2Z)-3-(3,4-dimethoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-ethylbutanamide
Smiles: CCC(C(=O)/N=C/1\SC2C(N1c1ccc(c(c1)OC)OC)CS(=O)(=O)C2)CC

STK610849
Synonyms: N-[(2Z)-3-(1,3-benzodioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]benzamide
Smiles: O=C(c1ccccc1)/N=C/1\SC2C(N1c1ccc3c(c1)OCO3)CS(=O)(=O)C2

STK610850
Synonyms: 3-(2-oxo-1,3-benzothiazol-3(2H)-yl)-N-[(2E)-4,5,6,7-tetrahydro-1,3-benzothiazol-2(3H)-ylidene]propanamide
Smiles: O=C(/N=c\1/sc2c([nH]1)CCCC2)CCn1c(=O)sc2c1cccc2

STK610852
Synonyms: 3-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-(2-methoxyethyl)propanamide
Smiles: COCCNC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C

STK610853
Synonyms: N-[(2Z)-5-(cyclohex-1-en-1-ylmethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3,4-dimethylbenzamide
Smiles: O=C(c1ccc(c(c1)C)C)/N=c\1/[nH]nc(s1)CC1=CCCCC1

STK610855
Synonyms: (4E)-4-[(4-butoxy-2-methylphenyl)(hydroxy)methylidene]-1-(pyridin-3-ylmethyl)-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)Cc1cccnc1)/O

STK610856
Synonyms: 3-({4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}carbonyl)-2H-chromen-2-one
Smiles: O=c1oc2ccccc2cc1C(=O)N1CCN(CC1)CCc1ccccn1

STK610857
Synonyms: 1-methoxypropan-2-ylcyano[3-(dipropylamino)quinoxalin-2-yl]acetate
Smiles: CCCN(c1nc2ccccc2nc1C(C(=O)OC(COC)C)C#N)CCC

STK610859
Synonyms: 6-hydroxy-1'-methyl-6'-nitro-2'-phenyl-2-sulfanyl-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one
Smiles: SC1=NC(=O)C2(C(=N1)O)Cc1cc(ccc1N(C2c1ccccc1)C)[N+](=O)[O-]

STK610863
Synonyms: 1-[(4-fluorophenyl)sulfonyl]-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F)Nc1nccs1

STK610864
Synonyms: (5Z)-6-hydroxy-5-[(2E)-1-hydroxy-3-(4-methoxyphenyl)prop-2-en-1-ylidene]-3-methylpyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)/C=C/C(=C/1\C(=NC(=O)N(C1=O)C)O)/O

STK610866
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-[3-(dimethylamino)propyl]-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CCCN(C)C

STK610869
Synonyms: 5-{3-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-2-hydroxypropyl}-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#Cc1c(C)cc(=O)n2c1n(CC(CN1CCN(CC1)c1nc(C)cc(n1)C)O)c1c2cccc1

STK610870
Synonyms: 1-[(2Z)-5-(2-fluorophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-methylphenyl)urea
Smiles: Cc1ccc(cc1)NC(=O)/N=c\1/[nH]nc(s1)c1ccccc1F

STK610871
Synonyms: 5-ethyl-8-oxo-N-{(2S)-1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: CCn1cc(C(=O)N[C@H](C(=O)N2CCN(CC2)c2ccccn2)C)c(=O)c2c1cc1OCOc1c2

STK610872
Synonyms: 2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-1-methyl-5-nitro-1H-benzimidazole
Smiles: Cc1nn(c(c1)C)CCc1nc2c(n1C)ccc(c2)[N+](=O)[O-]

STK610873
Synonyms: 9-(3,5-difluorophenyl)-6-(thiophen-2-yl)-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Fc1cc(cc(c1)F)C1C2=C(O)CC(CC2=Nc2n1nc(n2)C(F)(F)F)c1cccs1

STK610874
Synonyms: 3-hydroxy-N-{4-oxo-4-[(pyridin-4-ylmethyl)amino]butyl}quinoxaline-1(2H)-carboxamide
Smiles: O=C(NCc1ccncc1)CCCNC(=O)N1CC(=Nc2c1cccc2)O

STK610876
Synonyms: 2-bromo-N-[3-(1H-tetrazol-1-yl)phenyl]benzamide
Smiles: O=C(c1ccccc1Br)Nc1cccc(c1)n1cnnn1

STK610877
Synonyms: N-(2-fluorophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]acetamide
Smiles: Fc1ccccc1N(C(=O)C)/C=C/1\Sc2c(C1=O)cccc2

STK610881
Synonyms: N-[(2Z)-3-(4-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(thiophen-2-yl)acetamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccc(cc1)Cl)CS(=O)(=O)C2)Cc1cccs1

STK610882
Synonyms: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)NCCc1c[nH]c2c1cc(Cl)cc2

STK610883
Synonyms: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylidene]-5-[4-(propan-2-yloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)F)/O)/C1c1ccc(cc1)OC(C)C

STK610884
Synonyms: N-[2-(dimethylamino)-5-(piperidin-1-ylsulfonyl)phenyl]-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridazine-3-carboxamide
Smiles: CN(c1ccc(cc1NC(=O)C1=NN(C(=O)CC1)c1ccccc1)S(=O)(=O)N1CCCCC1)C

STK610886
Synonyms: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: N#Cc1c(NC(=O)c2nn3c(c2)NC(CC3C(F)(F)F)c2ccco2)sc2c1CCC(C2)C

STK610887
Synonyms: 3,4,5-triethoxy-N-[1-oxo-1-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)propan-2-yl]benzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)NC(C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1)C

STK610888
Synonyms: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-2-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetamide
Smiles: CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)NCCc1c[nH]c2c1cc(Cl)cc2

STK610889
Synonyms: 1-[(7-benzyl-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]pyrrolidine-2,5-dione
Smiles: O=C1CCC(=O)N1Nc1ncnc2c1c(C)c(n2Cc1ccccc1)C

STK610893
Synonyms: 1-(pyrrolidin-1-yl)-2-[1-(pyrrolidin-1-ylmethyl)-1H-indol-3-yl]ethanone
Smiles: O=C(N1CCCC1)Cc1cn(c2c1cccc2)CN1CCCC1

STK610894
Synonyms: 6-hydroxy-3-methyl-8-[4-(2-phenylethyl)piperazin-1-yl]-7-propyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)CCc1ccccc1

STK610895
Synonyms: 1-[(4-fluorophenyl)sulfonyl]-N-[3-oxo-3-(phenylamino)propyl]piperidine-4-carboxamide
Smiles: O=C(Nc1ccccc1)CCNC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F

STK610896
Synonyms: 3,6-dimethyl-N-(4-phenyl-1,2,5-oxadiazol-3-yl)-1-benzofuran-2-carboxamide
Smiles: Cc1ccc2c(c1)oc(c2C)C(=O)Nc1nonc1c1ccccc1

STK610898
Synonyms: 5-({[2-(1-benzylpiperidin-4-yl)ethyl]amino}methylidene)-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=S)N(C)C(=O)C(=CNCCC2CCN(CC2)Cc2ccccc2)C1=O

STK610899
Synonyms: 4-methyl-2-phenyl-N-(tetrahydrofuran-2-ylmethyl)-1,3-thiazole-5-carboxamide
Smiles: O=C(c1sc(nc1C)c1ccccc1)NCC1CCCO1

STK610902
Synonyms: (4E)-5-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-4-{hydroxy[3-methyl-4-(2-methylpropoxy)phenyl]methylidene}pyrrolidine-2,3-dione
Smiles: CC(COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Cl)CCCN(C)C)/O)C

STK610904
Synonyms: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-2-[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(COc1ccc2c(c1)oc(=O)c(c2C)C)NCCc1c[nH]c2c1cc(Cl)cc2

STK610905
Synonyms: 2-(3-ethyl-5-methyl-7-oxo-2-thioxo-3,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-6(2H)-yl)-N-phenylacetamide
Smiles: CCn1c(=S)sc2c1nc(C)n(c2=O)CC(=O)Nc1ccccc1

STK610907
Synonyms: (7Z)-3-(3-chlorophenyl)-7-(pyridin-3-ylmethylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Smiles: Clc1cccc(c1)N1CN=c2n(C1)c(=O)/c(=C/c1cccnc1)/s2

STK610908
Synonyms: (2Z)-4-methyl-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: [O-]c1cc(C)c2c(c1C[NH+]1CCOCC1)O/C(=C\c1cccs1)/C2=O

STK610910
Synonyms: 1-(3,4-dimethylphenyl)-3-[(2Z)-5-{2-[(4-fluorobenzyl)sulfanyl]phenyl}-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: Fc1ccc(cc1)CSc1ccccc1c1n[nH]/c(=N/C(=O)Nc2ccc(c(c2)C)C)/s1

STK610911
Synonyms: 4-(pentyloxy)-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: CCCCCOc1ccc(cc1)C(=O)/N=c\1/[nH]nc(s1)S(=O)(=O)CCC

STK610912
Synonyms: 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]-N-[2-(5-fluoro-1H-indol-3-yl)ethyl]acetamide
Smiles: O=C(COc1cc2oc(=O)c3c(c2cc1Cl)CCC3)NCCc1c[nH]c2c1cc(F)cc2

STK610913
Synonyms: N-(3,5-dichlorophenyl)-2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)Nc1cc(Cl)cc(c1)Cl

STK610915
Synonyms: N'-{(1E)-1-[4-hydroxy-1-(4-methoxyphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]ethyl}pentanehydrazide
Smiles: CCCCC(=O)NN/C(=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)/C

STK610916
Synonyms: (2E)-N-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)ethyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)NCCc2csc3=NCCn23)ccc1OC

STK610919
Synonyms: N-[2-oxo-3-(2-oxo-2-phenylethyl)-1-(propan-2-yl)-2,3-dihydro-1H-indol-3-yl]acetamide
Smiles: CC(=O)NC1(CC(=O)c2ccccc2)c2ccccc2N(C1=O)C(C)C

STK610921
Synonyms: 2-[(4-butyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]-N-(pyridin-2-yl)acetamide
Smiles: CCCCc1cc(=O)oc2c1c(OCC(=O)Nc1ccccn1)cc(c2)C

STK610925
Synonyms: (2E)-N-[(2E)-5-(butylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-chlorophenyl)prop-2-enamide
Smiles: CCCCS(=O)(=O)c1n[nH]/c(=N\C(=O)/C=C/c2ccc(cc2)Cl)/s1

STK610927
Synonyms: N-{4-[(2-fluorophenyl)amino]-4-oxobutyl}-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: OC1=Nc2ccccc2N(C1)C(=O)NCCCC(=O)Nc1ccccc1F

STK610928
Synonyms: N-{(2S)-1-[(4-methylbenzyl)amino]-1-oxo-3-phenylpropan-2-yl}-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: Cc1ccc(cc1)CNC(=O)[C@@H](NC(=O)N1CCn2c1nc1c2cccc1)Cc1ccccc1

STK610929
Synonyms: 2-[2-(dimethylamino)ethyl]-7-fluoro-1-(pyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CN(CCN1C(=O)c2c(C1c1ccccn1)c(=O)c1c(o2)ccc(c1)F)C

STK610932
Synonyms: (2E)-3-(3-methoxyphenyl)-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]prop-2-enamide
Smiles: CSCC[C@@H](c1nnc2n1cccc2)NC(=O)/C=C/c1cccc(c1)OC

STK610934
Synonyms: 2-ethyl-11-(4-methoxyphenyl)-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: C=CCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)OC

STK610938
Synonyms: N-(butan-2-yl)-N'-(quinolin-5-yl)ethanediamide
Smiles: CCC(NC(=O)C(=O)Nc1cccc2c1cccn2)C

STK610939
Synonyms: methyl2-{(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(c(c1)OC)OC

STK610942
Synonyms: 5'-(3-nitrophenyl)-2',4'-dihydrospiro[indole-3,3'-pyrazol]-2(1H)-one
Smiles: O=C1Nc2c(C31NN=C(C3)c1cccc(c1)[N+](=O)[O-])cccc2

STK610945
Synonyms: methyl{7-hydroxy-4-methyl-2-oxo-8-[(propan-2-ylamino)methyl]-2H-chromen-3-yl}acetate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2CNC(C)C)O

STK610946
Synonyms: 1-(3-chloro-4-fluorophenyl)-2-(2-chlorophenyl)-1H-imidazo[4,5-b]quinoxaline
Smiles: Clc1ccccc1c1nc2c(n1c1ccc(c(c1)Cl)F)nc1c(n2)cccc1

STK610949
Synonyms: 2-(2-{[7,7-dimethyl-2-(propylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]amino}ethoxy)ethanol
Smiles: CCCSc1nc(NCCOCCO)c2c(n1)c1COC(Cc1s2)(C)C

STK610953
Synonyms: 5-(4-chlorophenyl)-4-hydroxy-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C1Nc2nc(nc(c2C(C1)c1ccc(cc1)Cl)O)c1ccccc1

STK610954
Synonyms: 8-{[(1-benzylpiperidin-4-yl)amino]methyl}-7-hydroxy-3,4-dimethyl-2H-chromen-2-one
Smiles: Oc1ccc2c(c1CNC1CCN(CC1)Cc1ccccc1)oc(=O)c(c2C)C

STK610955
Synonyms: 6-iodo-2-[(Z)-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C\1/c2ccccc2N(C1=O)C)c1ccc(cc1)[N+](=O)[O-]

STK610956
Synonyms: 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(2-methylphenyl)quinazolin-4(3H)-one
Smiles: C/C(=C/CSc1nc2ccccc2c(=O)n1c1ccccc1C)/Cl

STK610958
Synonyms: (4E)-1-[3-(dimethylamino)propyl]-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)OC)CCCN(C)C)/O

STK610960
Synonyms: 5-ethyl-8-oxo-N-{2-oxo-2-[(2-oxo-2H-chromen-6-yl)amino]ethyl}-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: CCn1cc(C(=O)NCC(=O)Nc2ccc3c(c2)ccc(=O)o3)c(=O)c2c1cc1OCOc1c2

STK610962
Synonyms: 1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Clc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1cc(Cl)ccc1Cl

STK610964
Synonyms: 2-({3-[(E)-2-(4,6-dihydroxy-5-nitropyrimidin-2-yl)ethenyl]-2-methyl-1H-indol-1-yl}methyl)benzonitrile
Smiles: N#Cc1ccccc1Cn1c(C)c(c2c1cccc2)/C=C/c1nc(O)c(c(n1)O)[N+](=O)[O-]

STK610966
Synonyms: N-butyl-2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]acetamide
Smiles: CCCCNC(=O)COc1cc(C)cc2c1c1CCCc1c(=O)o2

STK610968
Synonyms: (4E)-1-[3-(diethylamino)propyl]-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: CCN(CCCN1C(c2ccccn2)/C(=C(/c2ccc(c(c2)C)OC)\O)/C(=O)C1=O)CC

STK610969
Synonyms: 4-ethyl-7-hydroxy-8-{[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl}-2H-chromen-2-one
Smiles: CCc1cc(=O)oc2c1ccc(c2CNC1CC(C)(C)NC(C1)(C)C)O

STK610970
Synonyms: 1-amino-4-{[3-(dimethylamino)propyl]amino}-2-(morpholin-4-yl)anthracene-9,10-dione
Smiles: CN(CCCNc1cc(N2CCOCC2)c(c2c1C(=O)c1ccccc1C2=O)N)C

STK610971
Synonyms: N-[(2Z)-4-(3,4-dimethoxyphenyl)-1,3-thiazol-2(3H)-ylidene]-2-(2-methylphenoxy)acetamide
Smiles: COc1cc(ccc1OC)c1cs/c(=N\C(=O)COc2ccccc2C)/[nH]1

STK610972
Synonyms: (5E)-1-ethyl-5-(1-{[2-(pyridin-3-yl)piperidin-1-yl]amino}ethylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=NC(=O)/C(=C(\NN2CCCCC2c2cccnc2)/C)/C1=O)S

STK610973
Synonyms: 6-(3-chlorophenyl)-9-(3,5-difluorophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Clc1cccc(c1)C1CC(=C2C(=Nc3n(C2c2cc(F)cc(c2)F)ncn3)C1)O

STK610974
Synonyms: 2,2'-{[7,7-dimethyl-2-(propylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]imino}diethanol
Smiles: OCCN(c1nc(SCCC)nc2c1sc1c2COC(C1)(C)C)CCO

STK610975
Synonyms: 3-(4-phenylpiperazin-1-yl)-1,2,4-triazin-5-ol
Smiles: Oc1cnnc(n1)N1CCN(CC1)c1ccccc1

STK610976
Synonyms: 4,7,7-trimethyl-2,3-dioxo-N-(quinolin-8-yl)bicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)Nc1cccc2c1nccc2

STK610979
Synonyms: 3-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]-N-(pyridin-3-yl)propanamide
Smiles: O=C(Nc1cccnc1)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)F

STK610980
Synonyms: 6-{[(2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanoyl]amino}hexanoicacid
Smiles: OC(=O)CCCCCNC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C

STK610981
Synonyms: 2-[4-(benzyloxy)-3-methoxyphenyl]-4-(4-fluorophenyl)-5-phenyl-1H-imidazole
Smiles: COc1cc(ccc1OCc1ccccc1)c1[nH]c(c(n1)c1ccc(cc1)F)c1ccccc1

STK610983
Synonyms: N-(2-methoxybenzyl)-N'-[2-oxo-1-(propan-2-yl)-2,3-dihydro-1H-indol-3-yl]ethanediamide
Smiles: COc1ccccc1CNC(=O)C(=O)NC1c2ccccc2N(C1=O)C(C)C

STK610985
Synonyms: 1-(4-fluorophenyl)-4-(3-methoxyphenyl)-3-methyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-6-ol
Smiles: COc1cccc(c1)C1CC(=Nc2c1c(C)nn2c1ccc(cc1)F)O

STK610986
Synonyms: 6-amino-7-[2-(3,4-dimethoxyphenyl)ethyl]-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(N)n(CCc2ccc(c(c2)OC)OC)c(=S)c2c1CC(C)(C)OC2

STK610987
Synonyms: N-[(2Z)-5,5-dioxido-3-(2-phenylethyl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=C/1\SC2C(N1CCc1ccccc1)CS(=O)(=O)C2

STK610989
Synonyms: N-(4-methoxyphenyl)-2-(3,7,7-trimethyl-2,4-dioxo-3,4,6,9-tetrahydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl)acetamide
Smiles: COc1ccc(cc1)NC(=O)Cn1c(=O)n(C)c(=O)c2c1c1COC(Cc1s2)(C)C

STK610990
Synonyms: tert-butyl2-amino-1-(3-chloro-4-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)C)OC(C)(C)C

STK610991
Synonyms: N-[(2Z)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-ylidene]-2-(2-oxo-1,3-benzothiazol-3(2H)-yl)acetamide
Smiles: Clc1ccc(cc1)c1cs/c(=N\C(=O)Cn2c(=O)sc3c2cccc3)/[nH]1

STK610993
Synonyms: (5E)-5-{1-[(4-fluorophenyl)amino]ethylidene}-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Fc1ccc(cc1)N/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/C

STK610994
Synonyms: ethyl(2-methyl-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)(oxo)acetate
Smiles: CCOC(=O)C(=O)N1C(C)CC(=O)Nc2c1cccc2

STK610995
Synonyms: 3-(4-chlorophenyl)-4-({(E)-[4,6-dioxo-1-(propan-2-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}amino)butanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)Cl)CN/C=C/1\C(=O)N=C(N(C1=O)C(C)C)S

STK610997
Synonyms: 5,6-dimethyl-3-(2-methylpropyl)-7-(pyridin-3-ylmethyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: CC(Cn1cnc2c(c1=N)c(C)c(n2Cc1cccnc1)C)C

STK610998
Synonyms: 6-(4-methoxyphenyl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-ylpyridine-4-carboxylate
Smiles: COc1ccc(cc1)c1cc(=O)c2c(c(c1)OC(=O)c1ccncc1)c(oc2C)C

STK610999
Synonyms: 4-hydroxy-2-phenyl-5-(4-propoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCOc1ccc(cc1)C1CC(=O)Nc2c1c(O)nc(n2)c1ccccc1

STK611001
Synonyms: (4E)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-(3-hydroxyphenyl)-4-[hydroxy(thiophen-2-yl)methylidene]pyrrolidine-2,3-dione
Smiles: Oc1cccc(c1)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1C1CCS(=O)(=O)C1

STK611003
Synonyms: (3S)-N-[(1R)-2-oxo-1-phenyl-2-{[4-(propan-2-yl)phenyl]amino}ethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C([C@@H](c1ccccc1)NC(=O)[C@H]1NCc2c(C1)cccc2)Nc1ccc(cc1)C(C)C

STK611004
Synonyms: 2-(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Cc1nn2c(n1)nc(c(c2C)Cc1ccccc1)C)Nc1cccc(c1)C(F)(F)F

STK611005
Synonyms: 2-[(4-methoxyphenoxy)methyl]-8,9-dimethyl-7-(pyridin-4-ylmethyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)Cc1ccncc1

STK611008
Synonyms: N'-[(E)-biphenyl-4-ylmethylidene]furan-2-carbohydrazide
Smiles: O=C(c1ccco1)N/N=C/c1ccc(cc1)c1ccccc1

STK611012
Synonyms: (5Z)-6-hydroxy-5-[5-(4-hydroxy-3-methoxyphenyl)pyrazolidin-3-ylidene]-3-methylpyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(ccc1O)C1NN/C(=C\2/C(=NC(=O)N(C2=O)C)O)/C1

STK611013
Synonyms: 2-[(4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
Smiles: O=C(NC1CC(C)(C)NC(C1)(C)C)COc1cc(C)cc2c1c(C)cc(=O)o2

STK611014
Synonyms: 7-(2-ethoxyphenyl)-N-(2-methoxyphenyl)-5-methyl-2-(methylsulfanyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: CCOc1ccccc1C1C(=C(C)N=c2n1nc([nH]2)SC)C(=O)Nc1ccccc1OC

STK611015
Synonyms: 2-{4-[2-(ethylsulfanyl)-7,7-dimethyl-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1nc(SCC)nc2c1sc1c2COC(C1)(C)C

STK611016
Synonyms: (2E)-3-(3,4-dimethoxyphenyl)-N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]prop-2-enamide
Smiles: COc1ccc(cc1OC)/C=C/C(=O)NCc1cc(=O)n(c(=O)n1C)C

STK611018
Synonyms: 8-{[(4-hydroxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-2,3-dimethyl-7,8-dihydro-4H-[1,3]thiazolo[3,2-a]thieno[3,2-e]pyrimidin-4-one
Smiles: Oc1nc(SCC2CSc3n2c2sc(c(c2c(=O)n3)C)C)nc2c1c1CCCCc1s2

STK611019
Synonyms: 1-(2,3-dimethoxyphenyl)-2-[3-(dimethylamino)propyl]-6-methoxy-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)CCCN(C)C)c1cccc(c1OC)OC

STK611020
Synonyms: ethyl4-({[(3R,3'S,5'R)-5'-(2-amino-2-oxoethyl)-7-chloro-5-methyl-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidin]-3'-yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1Cl)CC(=O)N

STK611022
Synonyms: (3E)-1,1,1-trifluoro-4-[(2-methoxyphenyl)amino]but-3-en-2-one
Smiles: COc1ccccc1N/C=C/C(=O)C(F)(F)F

STK611025
Synonyms: 3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[3-(4-methoxyphenyl)-1H-1,2,4-triazol-5-yl]propanamide
Smiles: COc1ccc(cc1)c1n[nH]c(n1)NC(=O)CCc1c(=O)oc2c(c1C)ccc(c2)OC

STK611026
Synonyms: 2-[(6-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-[3-(morpholin-4-yl)propyl]acetamide
Smiles: O=C(COc1cc2oc(=O)cc(c2cc1Cl)C)NCCCN1CCOCC1

STK611027
Synonyms: 8-{[(1-benzylpiperidin-4-yl)amino]methyl}-4-ethyl-7-hydroxy-2H-chromen-2-one
Smiles: CCc1cc(=O)oc2c1ccc(c2CNC1CCN(CC1)Cc1ccccc1)O

STK611028
Synonyms: 3,6-dichloro-N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}pyridine-2-carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)CNC(=O)c1nc(Cl)ccc1Cl

STK611029
Synonyms: N-(1,3-benzothiazol-2-yl)-2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(Nc1nc2c(s1)cccc2)COc1ccc2c(c1C)oc(=O)cc2C

STK611030
Synonyms: 6-amino-7-(3-methylphenyl)-3-(propan-2-yl)-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c2CC(OCc2c(=S)n(c1N)c1cccc(c1)C)C(C)C

STK611038
Synonyms: 1-(4-chlorophenyl)-3-[(2Z)-5-[(4-propylphenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: CCCc1ccc(cc1)OCc1n[nH]/c(=N/C(=O)Nc2ccc(cc2)Cl)/s1

STK611040
Synonyms: 2-methyl-N-{2-[(4-phenylpiperazin-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}propanamide
Smiles: CCCn1c(CN2CCN(CC2)c2ccccc2)nc2c1ccc(c2)NC(=O)C(C)C

STK611041
Synonyms: 1-(4-tert-butylphenyl)-6-methoxy-2-(5-methyl-1,3,4-thiadiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)c1nnc(s1)C)c1ccc(cc1)C(C)(C)C

STK611044
Synonyms: 3-(4-ethylpiperazin-1-yl)-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: CCN1CCN(CC1)c1nc(CC(C)C)c2c(c1C#N)CCCC2

STK611045
Synonyms: 2-[(2-oxo-4-propyl-2H-chromen-7-yl)oxy]-N-(pyridin-2-yl)acetamide
Smiles: CCCc1cc(=O)oc2c1ccc(c2)OCC(=O)Nc1ccccn1

STK611046
Synonyms: N-(2-chloro-4-nitrophenyl)-1-(4-ethylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: CCc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1ccc(cc1Cl)[N+](=O)[O-]

STK611047
Synonyms: N-(4-{[4-(benzyloxy)phenyl]amino}-4-oxobutyl)-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CCCNC(=O)N1CC(=Nc2c1cccc2)O

STK611049
Synonyms: 4-chloro-5-[(4-methoxyphenyl)amino]-2-(1-methyl-1H-benzimidazol-2-yl)pyridazin-3(2H)-one
Smiles: COc1ccc(cc1)Nc1cnn(c(=O)c1Cl)c1nc2c(n1C)cccc2

STK611052
Synonyms: 5-[(3-methylphenyl)amino]-3-(4-phenylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: Cc1cccc(c1)Nc1cc(N2CCN(CC2)c2ccccc2)c2c3c1C(=O)c1ccccc1c3on2

STK611053
Synonyms: 4-(2,4-dichlorophenoxy)-N-[3-(1H-tetrazol-1-yl)phenyl]butanamide
Smiles: O=C(Nc1cccc(c1)n1cnnn1)CCCOc1ccc(cc1Cl)Cl

STK611054
Synonyms: methyl2-{[7,7-dimethyl-4-(3-methylphenyl)-5-oxo-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}propanoate
Smiles: COC(=O)C(Sc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)(C)C)C

STK611055
Synonyms: N-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-{[7-(2-fluorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetamide
Smiles: CCc1n[nH]/c(=N\C(=O)CSc2nc3c(n2Cc2ccccc2F)c(=O)n(c(=O)n3C)C)/s1

STK611056
Synonyms: 2-(2-fluorophenoxy)-N-[4-(thiophen-2-yl)-1,2,5-oxadiazol-3-yl]butanamide
Smiles: CCC(C(=O)Nc1nonc1c1cccs1)Oc1ccccc1F

STK611057
Synonyms: 5-(tetrahydrofuran-2-ylmethyl)-N-[(2Z)-4,6,7-trimethylquinazolin-2(1H)-ylidene]-1,4,5,6-tetrahydro-1,3,5-triazin-2-amine
Smiles: Cc1cc2c(C)n/c(=N\C3=NCN(CN3)CC3CCCO3)/[nH]c2cc1C

STK611058
Synonyms: N-[(2Z)-3-[4-(dimethylamino)phenyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide
Smiles: COc1ccc(cc1OC)C(=O)/N=C/1\SC2C(N1c1ccc(cc1)N(C)C)CS(=O)(=O)C2

STK611059
Synonyms: [(2E)-3-(4-hydroxyphenyl)-4-oxo-2-{(2E)-[(2E)-3-phenylprop-2-en-1-ylidene]hydrazinylidene}-1,3-thiazolidin-5-yl]aceticacid
Smiles: OC(=O)CC1S/C(=N/N=C/C=C/c2ccccc2)/N(C1=O)c1ccc(cc1)O

STK611060
Synonyms: 2-[(2,4-dichlorobenzyl)sulfanyl]-5,6-dimethyl-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: C=CCn1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)c(C)c(s2)C

STK611065
Synonyms: 3-(2,5-dibromophenyl)-2-ethylquinazolin-4(3H)-one
Smiles: CCc1nc2ccccc2c(=O)n1c1cc(Br)ccc1Br

STK611066
Synonyms: 1-(furan-2-ylmethyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea
Smiles: O=C(NC1(C)CCS(=O)(=O)C1)NCc1ccco1

STK611067
Synonyms: 3-(2,4-dichlorophenyl)-6-(4-ethylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazine
Smiles: CCN1CCN(CC1)c1ccc2n(n1)c(nn2)c1ccc(cc1Cl)Cl

STK611069
Synonyms: 2-(5-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Cn1c(=O)oc2c1cc(Cl)cc2)Nc1ccccc1C(F)(F)F

STK611071
Synonyms: N-[(2Z)-3-(2-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenoxypropanamide
Smiles: COc1ccccc1N1/C(=N/C(=O)C(Oc2ccccc2)C)/SC2C1CS(=O)(=O)C2

STK611074
Synonyms: (4Z)-4-[6-methoxy-2-(3,4,5-trimethoxyphenyl)-4H-chromen-4-ylidene]-2-phenyl-1,3-oxazol-5(4H)-one
Smiles: COc1ccc2c(c1)/C(=C/1\N=C(OC1=O)c1ccccc1)/C=C(O2)c1cc(OC)c(c(c1)OC)OC

STK611075
Synonyms: 3-methylbutyl(2Z)-3-(1,3-benzodioxol-5-yl)-2-[(phenylcarbonyl)amino]prop-2-enoate
Smiles: CC(CCOC(=O)/C(=C/c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)C

STK611076
Synonyms: 5-benzyl-2-(4,6-dimethylpyrimidin-2-yl)-4-hydroxy-6-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: Cc1cc(C)nc(n1)n1[nH]c2c(c1=O)c(O)c(c(n2)C)Cc1ccccc1

STK611077
Synonyms: N-(2-methoxyethyl)-2-[(2-oxo-4-phenyl-2H-chromen-7-yl)oxy]acetamide
Smiles: COCCNC(=O)COc1ccc2c(c1)oc(=O)cc2c1ccccc1

STK611078
Synonyms: (5Z)-5-(3-chloro-4-hydroxybenzylidene)-1-(2-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\c1ccc(c(c1)Cl)O)c1ccccc1F

STK611079
Synonyms: N~2~-[(2,4-difluorophenyl)sulfonyl]-N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]glycinamide
Smiles: O=C(CNS(=O)(=O)c1ccc(cc1F)F)NCc1cc(=O)n(c(=O)n1C)C

STK611081
Synonyms: 2-[2-(dimethylamino)ethyl]-7-fluoro-1-(pyridin-4-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CN(CCN1C(=O)c2c(C1c1ccncc1)c(=O)c1c(o2)ccc(c1)F)C

STK611083
Synonyms: (3a'S,6a'R)-5-bromo-5'-tert-butyl-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: Oc1ccc(cc1)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cc(Br)cc1

STK611086
Synonyms: 5-{4-[(4-fluorobenzyl)oxy]-3-methoxyphenyl}-4-hydroxy-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: COc1cc(ccc1OCc1ccc(cc1)F)C1CC(=O)Nc2c1c(O)nc(n2)c1ccccc1

STK611087
Synonyms: 5-ethyl-N-[(2S)-4-(methylsulfanyl)-1-{[3-(morpholin-4-yl)propyl]amino}-1-oxobutan-2-yl]-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: CSCC[C@@H](C(=O)NCCCN1CCOCC1)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1

STK611089
Synonyms: 2-{3-[bis(2-methylpropyl)amino]quinoxalin-2-yl}-2-cyano-N-hexylacetamide
Smiles: CCCCCCNC(=O)C(c1nc2ccccc2nc1N(CC(C)C)CC(C)C)C#N

STK611091
Synonyms: (4E)-1-[3-(dimethylamino)propyl]-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C\1/C(c2cc(OC)c(c(c2)OC)OC)N(C(=O)C1=O)CCCN(C)C)/O

STK611093
Synonyms: N-[(2S)-1-(azepan-1-yl)-3-methyl-1-oxobutan-2-yl]-1-[(4-methoxyphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)N1CCCCCC1)C(C)C

STK611096
Synonyms: N-[3-(4-chlorophenyl)-6-methylheptyl]-1,3-thiazol-2-amine
Smiles: CC(CCC(c1ccc(cc1)Cl)CCNc1nccs1)C

STK611097
Synonyms: N-{3-oxo-3-[(pyridin-2-ylmethyl)amino]propyl}-1-(phenylsulfonyl)piperidine-4-carboxamide
Smiles: O=C(NCc1ccccn1)CCNC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1

STK611098
Synonyms: N-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: COc1cc(CCNC(=O)CNC(=O)c2cn(CC)c3c(c2=O)cc2c(c3)OCO2)ccc1OC

STK611099
Synonyms: 2-(5,7-dihydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[3-(1H-imidazol-1-yl)propyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(O)cc(c2)O)NCCCn1cncc1

STK611100
Synonyms: 1-(3,4-dimethylphenyl)-6-methyl-5-(2-phenylethyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Smiles: Cc1ccc(cc1C)n1ncc2c1nc(C)n(c2=O)CCc1ccccc1

STK611101
Synonyms: N-(1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-methyl-1-oxobutan-2-yl)-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: COc1cc(CCNC(=O)C(C(C)C)NC(=O)N2CC(=Nc3c2cccc3)O)ccc1OC

STK611102
Synonyms: 1-[(4-methoxyphenyl)sulfonyl]-N-{3-oxo-3-[(pyridin-3-ylmethyl)amino]propyl}piperidine-4-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NCCC(=O)NCc1cccnc1

STK611103
Synonyms: N-benzyl-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzenesulfonamide
Smiles: Cc1ccc(cc1)c1noc(n1)CN(S(=O)(=O)c1ccccc1)Cc1ccccc1

STK611104
Synonyms: 3-[4-phenyl-5-(thiophen-2-yl)-1H-imidazol-2-yl]-1H-indole
Smiles: c1ccc(cc1)c1nc([nH]c1c1cccs1)c1c[nH]c2c1cccc2

STK611108
Synonyms: 3-{3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-3-oxopropyl}-4,11-dimethyl-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-2-one
Smiles: OC[C@H]1CCCN1C(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2

STK611109
Synonyms: 6-iodo-3-(naphthalen-2-yl)-2-[(E)-2-(2-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccccc1[N+](=O)[O-])c1ccc2c(c1)cccc2

STK611110
Synonyms: 4-chloro-N-[(1Z)-1-(2-methyl-1,1-dioxido-4-oxo-2H-1,2-benzothiazin-3(4H)-ylidene)ethyl]benzamide
Smiles: Clc1ccc(cc1)C(=O)N/C(=C\1/C(=O)c2ccccc2S(=O)(=O)N1C)/C

STK611112
Synonyms: (4E)-5-(3-bromophenyl)-4-[(4-fluorophenyl)(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: Brc1cccc(c1)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1c1noc(c1)C

STK611115
Synonyms: 3-(3-{4-[bis(4-fluorophenyl)methyl]piperazin-1-yl}-3-oxopropyl)-7-hydroxy-4-methyl-2H-chromen-2-one
Smiles: Fc1ccc(cc1)C(c1ccc(cc1)F)N1CCN(CC1)C(=O)CCc1c(=O)oc2c(c1C)ccc(c2)O

STK611116
Synonyms: 1-[(4-methoxyphenyl)sulfonyl]-N-(3-phenylpropyl)piperidine-4-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NCCCc1ccccc1

STK611117
Synonyms: 5-{4-[(2-fluorobenzyl)oxy]phenyl}-4-hydroxy-2-methyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C1Nc2nc(C)nc(c2C(C1)c1ccc(cc1)OCc1ccccc1F)O

STK611120
Synonyms: N-[6-(cyclohexylamino)-6-oxohexyl]-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: O=C(NC1CCCCC1)CCCCCNC(=O)N1CCn2c1nc1c2cccc1

STK611121
Synonyms: 1-(butan-2-yl)-3-hydroxy-4-(4-nitrophenyl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: CCC(n1nc(c2c1NC(=O)CSC2c1ccc(cc1)[N+](=O)[O-])O)C

STK611125
Synonyms: 2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[2-(1H-imidazol-4-yl)ethyl]acetamide
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)NCCc1c[nH]cn1

STK611126
Synonyms: 1-(2-methylpropyl)-3-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
Smiles: N#Cc1c(nc(c2c1CCC2)CC(C)C)N1CCN(CC1)CC(=O)N1CCCC1

STK611127
Synonyms: 1-(3,4-dichlorophenyl)-3-[(2Z)-5-(3,4-dichlorophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)/N=c\1/[nH]nc(s1)c1ccc(c(c1)Cl)Cl

STK611128
Synonyms: (4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-[3-(morpholin-4-yl)propyl]-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: Cc1cccc(c1)COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)CCCN1CCOCC1)/O

STK611129
Synonyms: ethyl4-{[3-(methoxycarbonyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)Nc1sc2c(c1C(=O)OC)CCC2

STK611130
Synonyms: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-4-ol
Smiles: COc1cccc(c1)N1CCN(CC1)c1nc(C)cc(n1)O

STK611131
Synonyms: N-(3,4-dichlorophenyl)-2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetamide
Smiles: O=C(CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2)Nc1ccc(c(c1)Cl)Cl

STK611133
Synonyms: N-(1-benzylpiperidin-4-yl)-2-[(4-ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]acetamide
Smiles: CCc1cc(=O)oc2c1c(OCC(=O)NC1CCN(CC1)Cc1ccccc1)cc(c2)C

STK611135
Synonyms: N-(2-bromophenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1ccccc1Br

STK611136
Synonyms: 6-chloro-2-[3-(furan-2-yl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-phenylquinazoline
Smiles: Cc1ccc(cc1)C1CC(=NN1c1nc2ccc(cc2c(n1)c1ccccc1)Cl)c1ccco1

STK611137
Synonyms: N-(3-chloro-4-fluorophenyl)-2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-chromen-7-yl)oxy]acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)COc1cc(O)c2c(c1)OC(CC2=O)(C)C

STK611138
Synonyms: ethyl2-{[(3-aminopropyl)carbamoyl]amino}-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: NCCCNC(=O)Nc1sc2c(c1C(=O)OCC)CC(OC2)(C)C

STK611139
Synonyms: (4E)-4-{hydroxy[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1-[3-(morpholin-4-yl)propyl]-5-(pyridin-4-yl)pyrrolidine-2,3-dione
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CCCN1CCOCC1)/O

STK611140
Synonyms: 2-(benzylsulfanyl)-5-chloro-N-phenylpyrimidine-4-carboxamide
Smiles: Clc1cnc(nc1C(=O)Nc1ccccc1)SCc1ccccc1

STK611142
Synonyms: methyl(2E)-[2-(4-methoxyphenyl)hydrazinylidene][(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethanoate
Smiles: COC(=O)/C(=N\Nc1ccc(cc1)OC)/Sc1nnnn1c1ccccc1

STK611143
Synonyms: 5-bromo-N-(3-methoxypropyl)-1H-indole-2-carboxamide
Smiles: COCCCNC(=O)c1cc2c([nH]1)ccc(c2)Br

STK611144
Synonyms: N-{(2S)-1-[(2-chlorobenzyl)amino]-4-methyl-1-oxopentan-2-yl}-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: CC(C[C@@H](C(=O)NCc1ccccc1Cl)NC(=O)N1CCn2c1nc1c2cccc1)C

STK611145
Synonyms: 2-(5,7-dihydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[3-(propan-2-yloxy)propyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(O)cc(c2)O)NCCCOC(C)C

STK611146
Synonyms: 6-(butan-2-yl)-2-hydroxy-1-(4-methoxybenzyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCC(N1CNc2c(C1)c(=O)nc(n2Cc1ccc(cc1)OC)O)C

STK611147
Synonyms: 3-hydroxy-N-[2-oxo-2-(phenylamino)ethyl]quinoxaline-1(2H)-carboxamide
Smiles: O=C(Nc1ccccc1)CNC(=O)N1CC(=Nc2c1cccc2)O

STK611150
Synonyms: 6-bromo-4-oxo-N-(pyridin-4-ylmethyl)-4H-chromene-2-carboxamide
Smiles: Brc1ccc2c(c1)c(=O)cc(o2)C(=O)NCc1ccncc1

STK611151
Synonyms: 2-[(7-methyl-2-oxo-4-propyl-2H-chromen-5-yl)oxy]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
Smiles: CCCc1cc(=O)oc2c1c(OCC(=O)NCCCN1CCCC1=O)cc(c2)C

STK611152
Synonyms: 4-(1,3-benzodioxol-5-yl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1c1ccc2c(c1)OCO2)Cn1c(nc2c1cccc2)c1ccccn1

STK611154
Synonyms: (4Z)-4-[2-(4-methoxyphenyl)-4H-chromen-4-ylidene]-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Smiles: COc1ccc(cc1)C1=C/C(=C\2/N=C(OC2=O)c2cc(OC)c(c(c2)OC)OC)/c2c(O1)cccc2

STK611156
Synonyms: methyl[6-chloro-4-methyl-2-oxo-9-(3,4,5-trimethoxyphenyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-3-yl]acetate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)cc(c1c2CN(CO1)c1cc(OC)c(c(c1)OC)OC)Cl

STK611163
Synonyms: 3,5-dichloro-N-[4-(4-fluorophenyl)-1,2,5-oxadiazol-3-yl]-4-propoxybenzamide
Smiles: CCCOc1c(Cl)cc(cc1Cl)C(=O)Nc1nonc1c1ccc(cc1)F

STK611164
Synonyms: 2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)Nc1ccc(cc1)OC(F)(F)F

STK611165
Synonyms: (4E)-5-(2,5-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1C1N(CCN(C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/O)OC

STK611167
Synonyms: 2-[(6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl)oxy]-N-(2-hydroxy-2-phenylethyl)acetamide
Smiles: CCc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)NCC(c1ccccc1)O

STK611169
Synonyms: 2-(4-{[3-(diethylamino)propyl]amino}-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-7-yl)ethanol
Smiles: OCCn1c(C)c(c2c1ncnc2NCCCN(CC)CC)C

STK611170
Synonyms: 4-(2-methylpropoxy)-N'-[(E)-(5-nitrofuran-2-yl)methylidene]benzohydrazide
Smiles: CC(COc1ccc(cc1)C(=O)N/N=C/c1ccc(o1)[N+](=O)[O-])C

STK611171
Synonyms: 5-(furan-2-yl)-N-(pyridin-2-ylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: O=C(c1cnn2c1NC(CC2C(F)(F)F)c1ccco1)NCc1ccccn1

STK611175
Synonyms: 2-[(4-ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]-N-(pyridin-4-ylmethyl)acetamide
Smiles: CCc1cc(=O)oc2c1c(OCC(=O)NCc1ccncc1)cc(c2)C

STK611176
Synonyms: 4,7-dimethyl-2-oxo-3-{2-oxo-2-[(4-phenylbutan-2-yl)amino]ethyl}-2H-chromen-5-ylacetate
Smiles: CC(NC(=O)Cc1c(=O)oc2c(c1C)c(OC(=O)C)cc(c2)C)CCc1ccccc1

STK611179
Synonyms: 2-{(E)-2-[3,4-dimethoxy-5-(prop-2-en-1-yl)phenyl]ethenyl}-5-nitropyrimidine-4,6-diol
Smiles: C=CCc1cc(/C=C/c2nc(O)c(c(n2)O)[N+](=O)[O-])cc(c1OC)OC

STK611180
Synonyms: 2-(naphthalen-1-yl)-4-phenyl-5-(thiophen-2-yl)-1H-imidazole
Smiles: c1ccc(cc1)c1nc([nH]c1c1cccs1)c1cccc2c1cccc2

STK611181
Synonyms: N-(4-sulfamoylphenyl)-2-(3,4,9-trimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c1occ(c1c(c2)C)C)Nc1ccc(cc1)S(=O)(=O)N

STK611183
Synonyms: 3-(4-ethylpiperazin-1-yl)-1-propyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: CCCc1nc(N2CCN(CC2)CC)c(c2c1CCCC2)C#N

STK611184
Synonyms: 1-(2-methoxyethyl)-3-[3-(trifluoromethyl)phenyl]tetrahydro-1H-thieno[3,4-d]imidazole-2(3H)-thione5,5-dioxide
Smiles: COCCN1C2CS(=O)(=O)CC2N(C1=S)c1cccc(c1)C(F)(F)F

STK611185
Synonyms: N-(4-chlorophenyl)-2-(3,7,7-trimethyl-2,4-dioxo-3,4,6,9-tetrahydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl)acetamide
Smiles: O=C(Cn1c(=O)n(C)c(=O)c2c1c1COC(Cc1s2)(C)C)Nc1ccc(cc1)Cl

STK611186
Synonyms: 5'-(4-methoxyphenyl)-2'-(phenylcarbonyl)-2',4'-dihydrospiro[indole-3,3'-pyrazol]-2(1H)-one
Smiles: COc1ccc(cc1)C1=NN(C2(C1)C(=O)Nc1c2cccc1)C(=O)c1ccccc1

STK611187
Synonyms: 2-[(3-benzyl-6-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(pyridin-3-yl)acetamide
Smiles: O=C(Nc1cccnc1)COc1cc2oc(=O)c(c(c2cc1Cl)C)Cc1ccccc1

STK611188
Synonyms: [5-(4-fluorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]{[2-(methylsulfanyl)phenyl]amino}methanol
Smiles: CSc1ccccc1NC(c1cnn2c1NC(CC2C(F)(F)F)c1ccc(cc1)F)O

STK611190
Synonyms: (4E)-5-(3,4-dichlorophenyl)-1-[3-(dimethylamino)propyl]-4-{hydroxy[2-methyl-4-(2-methylpropoxy)phenyl]methylidene}pyrrolidine-2,3-dione
Smiles: CC(COc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)CCCN(C)C)/O)C

STK611194
Synonyms: 6-[(4-phenylpiperazin-1-yl)carbonyl]-1,4-dihydroquinoxaline-2,3-dione
Smiles: O=C(c1ccc2c(c1)[nH]c(=O)c(=O)[nH]2)N1CCN(CC1)c1ccccc1

STK611195
Synonyms: 8-nitro-1'-(propan-2-yl)-2'-sulfanyl-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: CC(N1C(=NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCCC1)[N+](=O)[O-])S)C

STK611200
Synonyms: methyl4-[(3E)-1-[3-(dimethylamino)propyl]-3-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-4,5-dioxopyrrolidin-2-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(CCCN(C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/O

STK611201
Synonyms: 3-methoxy-N-[2-([1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl]benzamide
Smiles: COc1cccc(c1)C(=O)NCCc1csc2n1ncn2

STK611202
Synonyms: 2-[(6-chloro-3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]-N-(2-hydroxy-2-phenylethyl)acetamide
Smiles: OC(c1ccccc1)CNC(=O)COc1cc2oc(=O)c(c(c2cc1Cl)C)C

STK611204
Synonyms: 2-fluoro-N-{2-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]ethyl}benzenesulfonamide
Smiles: Fc1ccccc1S(=O)(=O)NCCc1csc(n1)c1cccs1

STK611207
Synonyms: 2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[3-(trifluoromethoxy)phenyl]acetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)Nc1cccc(c1)OC(F)(F)F

STK611208
Synonyms: ethyl2-phenyl-4-(pyridin-4-yl)-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: CCOC(=O)C1=C(N=c2n(C1c1ccncc1)c1ccccc1[nH]2)c1ccccc1

STK611209
Synonyms: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2-hydroxy-1'-methyl-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H)-dione
Smiles: COc1cc(CCN2C(=NC(=O)C3(C2=O)CN(C)c2c(C3)cc(cc2)[N+](=O)[O-])O)ccc1OC

STK611210
Synonyms: 1-methyl-3-(morpholin-4-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(nc(c2c1CCCC2)C)N1CCOCC1

STK611211
Synonyms: 2-(4-methoxyphenyl)-3-{3-[2-(propan-2-yl)phenoxy]propyl}quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccccc1C(C)C

STK611212
Synonyms: 1-(4-fluorophenyl)-5-(4-methoxybenzyl)-6-methyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Smiles: COc1ccc(cc1)Cn1c(C)nc2c(c1=O)cnn2c1ccc(cc1)F

STK611213
Synonyms: N-[1-oxo-1-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)propan-2-yl]naphthalene-2-carboxamide
Smiles: O=C(C(NC(=O)c1ccc2c(c1)cccc2)C)N1CCC2(CC1)NCCc1c2[nH]cn1

STK611216
Synonyms: 4-({[2-(3-fluorophenyl)ethyl]amino}methyl)-3-hydroxy-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Smiles: Fc1cccc(c1)CCNCc1c(O)ccc2c1oc(=O)c1c2CCCC1

STK611217
Synonyms: 3,3'-(pyridin-4-ylmethanediyl)diquinoline-2,4-diol
Smiles: Oc1nc2ccccc2c(c1C(c1c(O)nc2c(c1O)cccc2)c1ccncc1)O

STK611218
Synonyms: N-[(2Z)-5-cyclopentyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-(2-fluorophenoxy)acetamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C1CCCC1)COc1ccccc1F

STK611219
Synonyms: (4E)-5-(2,3-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-[(4-fluorophenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: COc1cccc(c1OC)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1CCN(C)C

STK611220
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-[(5Z)-5-(4-fluorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-methylacetamide
Smiles: Fc1ccc(cc1)/C=C/1\SC(=O)N(C1=O)CC(=O)N(C1CCS(=O)(=O)C1)C

STK611222
Synonyms: 3-benzyl-5,6-dimethyl-7-(pyridin-3-ylmethyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1c(C)c2c(n1Cc1cccnc1)ncn(c2=N)Cc1ccccc1

STK611223
Synonyms: 2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4,6-dimethylpyridine-3-carbonitrile
Smiles: COc1ccc(cc1OC)CCNc1nc(C)cc(c1C#N)C

STK611224
Synonyms: 2-[4-(4-hydroxy-7-oxo-2-phenyl-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidin-5-yl)-2-methoxyphenoxy]acetamide
Smiles: COc1cc(ccc1OCC(=O)N)C1CC(=O)Nc2c1c(O)nc(n2)c1ccccc1

STK611225
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)OCC)N(C(=O)C1=O)Cc1cccnc1)/O

STK611226
Synonyms: 3-(butan-2-yl)-11-(2-chlorobenzyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCC(n1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1Cl)C

STK611228
Synonyms: 6-chloro-9-(2,4-dimethoxybenzyl)-3,4-dimethyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: COc1cc(OC)ccc1CN1COc2c(C1)c1oc(=O)c(c(c1cc2Cl)C)C

STK611229
Synonyms: 7-ethyl-8-[4-(2-fluorobenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1F

STK611230
Synonyms: (5Z)-3-{1-[2-(2-hydroxyethyl)piperidin-1-yl]-1-oxopropan-2-yl}-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: OCCC1CCCCN1C(=O)C(N1C(=S)S/C(=C\c2cccs2)/C1=O)C

STK611235
Synonyms: N-{3-[(3-fluoro-4-methylphenyl)amino]-3-oxopropyl}-1-(phenylsulfonyl)piperidine-4-carboxamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CCNC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1

STK611236
Synonyms: 2-{[oxo(2-phenylhydrazinyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(C(=O)NNc1ccccc1)Nc1sc2c(c1C(=O)N)CCCC2

STK611237
Synonyms: 2-(3,4-dimethoxyphenyl)-N-(3-methoxypropyl)-4-methyl-1,3-thiazole-5-carboxamide
Smiles: COCCCNC(=O)c1sc(nc1C)c1ccc(c(c1)OC)OC

STK611242
Synonyms: (4E)-5-(4-tert-butylphenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)C(C)(C)C)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)/O

STK611245
Synonyms: methyl(7-{2-[(1,1-dioxidotetrahydrothiophen-3-yl)(methyl)amino]-2-oxoethoxy}-4-methyl-2-oxo-2H-chromen-3-yl)acetate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)OCC(=O)N(C1CCS(=O)(=O)C1)C

STK611246
Synonyms: ethyl4-{3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperazine-1-carboxylate
Smiles: CCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)C(=O)OCC)/C1=O

STK611247
Synonyms: (5Z)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-1-(4-methoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C/c2ccc(o2)c2ccc(cc2)F)/C1=O)S

STK611250
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]-1-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2cccc(c2)OC)\O)/C(=O)C(=O)N1c1ccccn1

STK611253
Synonyms: 1-(3,4-dichlorophenyl)-3-[(2Z)-5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: Cc1ccc(c(c1)OCc1n[nH]/c(=N/C(=O)Nc2ccc(c(c2)Cl)Cl)/s1)C(C)C

STK611255
Synonyms: S-benzyl-N~2~-{[(4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy]acetyl}-N-(tetrahydrofuran-2-ylmethyl)-L-cysteinamide
Smiles: O=C(N[C@H](C(=O)NCC1CCCO1)CSCc1ccccc1)COc1ccc2c(c1C)oc(=O)c1c2cccc1

STK611257
Synonyms: 1-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-3-[2-(dimethylamino)ethyl]urea
Smiles: N#Cc1c(NC(=O)NCCN(C)C)sc2c1CC(C)(C)OC2

STK611259
Synonyms: N-{[5-(4-chlorophenyl)furan-2-yl]methyl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)pentanamide
Smiles: CCCCC(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(o1)c1ccc(cc1)Cl

STK611261
Synonyms: N-{3-[(4-methoxybenzyl)amino]-3-oxopropyl}-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: COc1ccc(cc1)CNC(=O)CCNC(=O)N1CCn2c1nc1c2cccc1

STK611262
Synonyms: (4E)-4-{hydroxy[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1-[3-(morpholin-4-yl)propyl]-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)CCCN1CCOCC1)/O

STK611263
Synonyms: 2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[2-(thiophen-3-yl)ethyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)NCCc1cscc1

STK611264
Synonyms: 2-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide
Smiles: OCC(Cc1ccccc1)NC(=O)C(N1C(=S)S/C(=C\c2ccc(cc2)F)/C1=O)C

STK611266
Synonyms: 2-[(4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]-N-(4-phenylbutan-2-yl)acetamide
Smiles: CC(NC(=O)COc1cc(C)cc2c1c(C)cc(=O)o2)CCc1ccccc1

STK611267
Synonyms: 4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2H-chromen-2-one
Smiles: CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N1CCN(CC1)c1ccccc1

STK611269
Synonyms: 3-{[3-(dimethylamino)propyl]sulfanyl}-1-(pyrrolidin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCCCN(C)C)nc(c2c1CCCC2)N1CCCC1

STK611271
Synonyms: 6-iodo-2-methyl-3-(2-phenylethyl)quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)C)CCc1ccccc1

STK611272
Synonyms: 2-{[7,7-dimethyl-2-(propylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]sulfanyl}ethanol
Smiles: OCCSc1nc(SCCC)nc2c1sc1c2COC(C1)(C)C

STK611273
Synonyms: (4E)-5-(3-bromophenyl)-4-[hydroxy(4-propoxyphenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Br)c1noc(c1)C)/O

STK611275
Synonyms: 2-{[5-(1-benzofuran-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}propanoicacid
Smiles: OC(=O)C(Sc1nnc(n1c1ccccc1)c1cc2c(o1)cccc2)C

STK611276
Synonyms: 4-ethoxy-N-[3-oxo-3-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)propyl]benzamide
Smiles: CCOc1ccc(cc1)C(=O)NCCC(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK611277
Synonyms: N-[3-(1H-imidazol-1-yl)propyl]-N'-(1-methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)ethanediamide
Smiles: O=C1N(C)c2c(C1NC(=O)C(=O)NCCCn1cncc1)cccc2

STK611278
Synonyms: 4-{[1-(4-bromophenyl)-1H-tetrazol-5-yl]methoxy}benzoicacid
Smiles: Brc1ccc(cc1)n1nnnc1COc1ccc(cc1)C(=O)O

STK611279
Synonyms: 3-{[(E)-(2-hydroxy-5-methyl-3-nitrophenyl)methylidene]amino}-2-[({[(1E)-1-phenylethylidene]amino}oxy)methyl]quinazolin-4(3H)-one
Smiles: Cc1cc(/C=N/n2c(CO/N=C(/c3ccccc3)\C)nc3c(c2=O)cccc3)c(c(c1)[N+](=O)[O-])O

STK611280
Synonyms: 7-{2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxoethoxy}-4-methyl-2H-chromen-2-one
Smiles: O=C(N1CCN(CC1)C(c1ccccc1)c1ccccc1)COc1ccc2c(c1)oc(=O)cc2C

STK611282
Synonyms: 4-butyl-N-[(2E)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]cyclohexanecarboxamide
Smiles: CCCCC1CCC(CC1)C(=O)/N=c/1\[nH]nc(s1)S(=O)(=O)CCC

STK611283
Synonyms: 8-amino-3-butyl-2-hydroxybenzo[g]pteridin-4(3H)-one
Smiles: CCCCn1c(O)nc2c(c1=O)nc1c(n2)cc(cc1)N

STK611285
Synonyms: 2-[(1,5-dimethyl-2-oxo-2,3-dihydro-1H-indol-3-yl)methyl]-3-methylquinazolin-4(3H)-one
Smiles: Cc1ccc2c(c1)C(Cc1nc3ccccc3c(=O)n1C)C(=O)N2C

STK611286
Synonyms: N-(4-{4-[(1-methyl-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}phenyl)-2-phenoxyacetamide
Smiles: O=C(Nc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1C)cccc2)COc1ccccc1

STK611289
Synonyms: 1-(4-methylpiperidin-1-yl)-3-{[2-(pyrrolidin-1-yl)ethyl]sulfanyl}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCCN2CCCC2)nc(c2c1CCCC2)N1CCC(CC1)C

STK611290
Synonyms: (4E)-5-(4-tert-butylphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[furan-2-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(C)(C)C)/C(=C(/c2ccco2)\O)/C(=O)C1=O

STK611294
Synonyms: 4-methyl-N-[2-(2-phenyl-1H-imidazol-5-yl)ethyl]benzamide
Smiles: Cc1ccc(cc1)C(=O)NCCc1cnc([nH]1)c1ccccc1

STK611297
Synonyms: 7-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethoxy}-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)COc1ccc2c(c1)oc(=O)c1c2CCC1

STK611298
Synonyms: (5Z)-3-(4-ethoxyphenyl)-6-hydroxy-5-{[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=O)N=C(/C(=C/c2ccc(o2)c2cc(ccc2OC)[N+](=O)[O-])/C1=O)O

STK611299
Synonyms: tert-butyl2-amino-1-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C(F)(F)F)OC(C)(C)C

STK611300
Synonyms: 6-hydroxy-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-(4-phenylpiperazin-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: OC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)c1ccccc1)COc1ccccc1

STK611304
Synonyms: N-[4-(4-fluorophenyl)-1,2,5-oxadiazol-3-yl]-2-(naphthalen-1-yl)acetamide
Smiles: O=C(Cc1cccc2c1cccc2)Nc1nonc1c1ccc(cc1)F

STK611305
Synonyms: 2-(naphthalen-1-yloxy)-N-[(2Z)-4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=c/1\scc([nH]1)C12CC3CC(C2)CC(C1)C3)COc1cccc2c1cccc2

STK611308
Synonyms: ethyl4-(4-oxo-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-2-yl)piperazine-1-carboxylate
Smiles: C=CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)C(=O)OCC)/C1=O

STK611309
Synonyms: N-{(2S)-1-[(3-hydroxypropyl)amino]-4-methyl-1-oxopentan-2-yl}-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: OCCCNC(=O)[C@@H](NC(=O)N1CCn2c1nc1c2cccc1)CC(C)C

STK611311
Synonyms: methylN-[3-(4-oxoquinazolin-3(4H)-yl)propanoyl]-N-phenyl-beta-alaninate
Smiles: COC(=O)CCN(c1ccccc1)C(=O)CCn1cnc2c(c1=O)cccc2

STK611312
Synonyms: N-[4-(2-hydroxyethyl)phenyl]-2-[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: OCCc1ccc(cc1)NC(=O)COc1ccc2c(c1C)oc(=O)c(c2C)C

STK611313
Synonyms: N'-{(E)-[3-(4-bromobenzyl)-4-chloro-2-oxo-2,3-dihydro-1,3-thiazol-5-yl]methylidene}-4-nitrobenzohydrazide
Smiles: Brc1ccc(cc1)Cn1c(=O)sc(c1Cl)/C=N/NC(=O)c1ccc(cc1)[N+](=O)[O-]

STK611315
Synonyms: 1-(2-chlorophenyl)-2-(2-methylphenyl)-1H-imidazo[4,5-b]quinoxaline
Smiles: Clc1ccccc1n1c(nc2c1nc1ccccc1n2)c1ccccc1C

STK611316
Synonyms: 2-[(6-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-(2-hydroxy-2-phenylethyl)acetamide
Smiles: O=C(COc1cc2oc(=O)cc(c2cc1Cl)C)NCC(c1ccccc1)O

STK611317
Synonyms: (4E)-4-[(4-butoxy-3-methylphenyl)(hydroxy)methylidene]-1-(2-methoxyethyl)-5-(pyridin-4-yl)pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)CCOC)/O

STK611318
Synonyms: 2-{4-[5-cyano-3,3-dimethyl-8-(propan-2-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]piperazin-1-yl}-N-(4-methoxyphenyl)acetamide
Smiles: N#Cc1c(nc(c2c1CC(C)(C)OC2)C(C)C)N1CCN(CC1)CC(=O)Nc1ccc(cc1)OC

STK611320
Synonyms: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-N'-(pyridin-4-ylmethyl)ethanediamide
Smiles: O=C(C(=O)Nc1sc2c(c1C(=O)N)CC(OC2)(C)C)NCc1ccncc1

STK611321
Synonyms: 6,7-dimethoxy-N,N-dimethyl-1-phenyl-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: COc1cc2c(cc1OC)CCN(C2c1ccccc1)C(=O)N(C)C

STK611322
Synonyms: 6-(2-chloro-4-fluorobenzyl)-3-ethyl-5-methyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: CCn1c(=S)sc2c1nc(C)n(c2=O)Cc1ccc(cc1Cl)F

STK611324
Synonyms: [4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl](2,3-dimethyl-1H-indol-5-yl)methanone
Smiles: O=C(c1ccc2c(c1)c(C)c([nH]2)C)N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)OCCO2

STK611326
Synonyms: N-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-4-methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)nc(n2C)CCn1nc(cc1C)C

STK611328
Synonyms: N-(3-carbamoyl-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-N'-(propan-2-yl)ethanediamide
Smiles: CC(NC(=O)C(=O)Nc1sc2c(c1C(=O)N)CC(OC2)(C)C)C

STK611329
Synonyms: N-(3-chloro-4-methoxyphenyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1ccc(c(c1)Cl)OC

STK611330
Synonyms: 2-[(4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]-N-[2-(4-methoxyphenyl)ethyl]acetamide
Smiles: COc1ccc(cc1)CCNC(=O)COc1cc(C)cc2c1c(C)cc(=O)o2

STK611331
Synonyms: (2E)-4-[5'-(1,3-benzodioxol-5-yl)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrazol]-2'(4'H)-yl]-4-oxobut-2-enoicacid
Smiles: OC(=O)/C=C/C(=O)N1N=C(CC21C(=O)Nc1c2cccc1)c1ccc2c(c1)OCO2

STK611332
Synonyms: 2-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N'-[(4-methoxyphenyl)acetyl]acetohydrazide
Smiles: COc1ccc(cc1)CC(=O)NNC(=O)Cc1nc2n(n1)c(C)cc(n2)C

STK611333
Synonyms: 2-[(2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]-N-(pyridin-2-ylmethyl)acetamide
Smiles: O=C(NCc1ccccn1)COc1cc2oc(=O)c3c(c2cc1Cl)CCCC3

STK611334
Synonyms: N-(2,2-dimethoxyethyl)-1-[(4-fluorophenyl)sulfonyl]piperidine-4-carboxamide
Smiles: COC(CNC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F)OC

STK611335
Synonyms: N-(3-bromophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)butanamide
Smiles: CCC(n1c(O)nc2c(c1=O)cccc2)C(=O)Nc1cccc(c1)Br

STK611336
Synonyms: 1,7-dimethyl-9-(4-methylphenyl)-3-[2-(piperidin-1-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CC1CN(c2ccc(cc2)C)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)CCN1CCCCC1

STK611337
Synonyms: 5-(2-bromophenyl)-6-[3-(diethylamino)propyl]-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: CCN(CCCn1cc2c(c1c1ccccc1Br)c(=O)n(c(=O)n2C)C)CC

STK611339
Synonyms: N-[3-(1H-imidazol-1-yl)propyl]-2-[(6-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]propanamide
Smiles: O=C(C(Oc1ccc2c(c1C)oc(=O)c1c2CCC1)C)NCCCn1cncc1

STK611340
Synonyms: (5Z)-5-(3,5-dibromo-2-methoxybenzylidene)-6-hydroxy-3-[3-(trifluoromethyl)phenyl]pyrimidine-2,4(3H,5H)-dione
Smiles: COc1c(cc(cc1Br)Br)/C=C\1/C(=NC(=O)N(C1=O)c1cccc(c1)C(F)(F)F)O

STK611342
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-{[3-cyano-6-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl}acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1sc2c(c1C#N)CCC2)c1ccc(c(c1)OC)OC

STK611343
Synonyms: 1-(furan-2-yl)-3-[(pyridin-3-ylmethyl)amino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(NCc2cccnc2)nc(c2c1CCCC2)c1ccco1

STK611345
Synonyms: 8-[2-(dimethylamino)ethyl]-1,3,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CN(CCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)C)C

STK611346
Synonyms: 1',3'-dimethyl-2'-thioxo-6a,7,8,9,10,11-hexahydro-2'H,5H-spiro[azepino[1,2-a]quinoline-6,5'-pyrimidine]-4',6'(1'H,3'H)-dione
Smiles: S=C1N(C)C(=O)C2(C(=O)N1C)Cc1ccccc1N1C2CCCCC1

STK611349
Synonyms: 1',3',4a-trimethyl-8-nitro-2'-thioxo-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H,3'H)-dione
Smiles: S=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc(ccc1N1C2(C)CCCC1)[N+](=O)[O-]

STK611350
Synonyms: N-{3-[(3-methoxyphenyl)amino]-3-oxopropyl}-1-[(4-methoxyphenyl)sulfonyl]piperidine-4-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NCCC(=O)Nc1cccc(c1)OC

STK611351
Synonyms: (2E)-N-[(2E)-5-benzyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2(1H)-ylidene]-2-cyano-3-[2-(trifluoromethyl)phenyl]prop-2-enamide
Smiles: N#C/C(=C\c1ccccc1C(F)(F)F)/C(=O)/N=c\1/sc2c([nH]1)CCN(C2)Cc1ccccc1

STK611352
Synonyms: N-[3-(1,3-benzodioxol-5-ylamino)-3-oxopropyl]-1-[(4-fluorophenyl)sulfonyl]piperidine-4-carboxamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CCNC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F

STK611353
Synonyms: 2-chloro-4-(5-{(Z)-[1-(3-fluorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: Fc1cccc(c1)N1C(=O)N=C(/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)C(=O)O)/C1=O)O

STK611354
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-3-oxo-2-(pyridin-4-ylmethyl)-2,3-dihydro-1H-isoindole-4-carboxamide
Smiles: O=C(c1cccc2c1C(=O)N(C2)Cc1ccncc1)NCc1ccc2c(c1)OCO2

STK611355
Synonyms: 2-[4-(5-cyano-3,3,8-trimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl)piperazin-1-yl]-N-(2-phenylethyl)acetamide
Smiles: N#Cc1c(nc(c2c1CC(C)(C)OC2)C)N1CCN(CC1)CC(=O)NCCc1ccccc1

STK611356
Synonyms: (4E)-1-[3-(dimethylamino)propyl]-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: CN(CCCN1C(c2cccnc2)/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\O)/C(=O)C1=O)C

STK611357
Synonyms: N-(2-{[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]amino}-2-oxoethyl)-3-methoxybenzamide
Smiles: COc1cccc(c1)C(=O)NCC(=O)NCc1cc(=O)n(c(=O)n1C)C

STK611359
Synonyms: 6-chloro-2-cyclohexyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1nc2nc(nn2c(c1Cl)O)C1CCCCC1

STK611361
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-{[5-(4-fluorophenyl)furan-2-yl]methyl}-2-nitrobenzamide
Smiles: Fc1ccc(cc1)c1ccc(o1)CN(C(=O)c1ccccc1[N+](=O)[O-])C1CCS(=O)(=O)C1

STK611364
Synonyms: methyl3-({(Z)-[4,6-dioxo-1-(2-phenylethyl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}amino)-6-methoxy-1H-indole-2-carboxylate
Smiles: COc1ccc2c(c1)[nH]c(c2N/C=C\1/C(=O)N=C(N(C1=O)CCc1ccccc1)S)C(=O)OC

STK611365
Synonyms: 3-hydroxy-N-{(2S)-1-oxo-3-phenyl-1-[(3-phenylpropyl)amino]propan-2-yl}quinoxaline-1(2H)-carboxamide
Smiles: OC1=Nc2ccccc2N(C1)C(=O)N[C@H](C(=O)NCCCc1ccccc1)Cc1ccccc1

STK611366
Synonyms: 3-(1,3-benzothiazol-2-ylsulfanyl)-N'-[(E)-(2-hydroxynaphthalen-1-yl)methylidene]propanehydrazide
Smiles: O=C(N/N=C/c1c(O)ccc2c1cccc2)CCSc1nc2c(s1)cccc2

STK611367
Synonyms: 2-methylpropylcyano[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate
Smiles: N#CC(c1nc2ccccc2nc1N1CCC(CC1)C)C(=O)OCC(C)C

STK611370
Synonyms: (3aS,6R,7aR)-N-[3-(diethylamino)propyl]-2-(4-methoxyphenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: CCN(CCCNC(=O)C1[C@@H]2C=C[C@@]3([C@@H]1C(=O)N(C3)c1ccc(cc1)OC)O2)CC

STK611371
Synonyms: 4-tert-butyl-N-[3-oxo-3-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)propyl]benzamide
Smiles: O=C(N1CCC2(CC1)NCCc1c2[nH]cn1)CCNC(=O)c1ccc(cc1)C(C)(C)C

STK611372
Synonyms: 2-methyl-11-(3-methylphenyl)-3-pentyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1cccc(c1)C

STK611373
Synonyms: N-{2-[2-(4-methylphenyl)-1H-imidazol-5-yl]ethyl}-2-phenylacetamide
Smiles: O=C(Cc1ccccc1)NCCc1cnc([nH]1)c1ccc(cc1)C

STK611374
Synonyms: 7,7-dimethyl-4-(morpholin-4-yl)-2-(propylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCSc1nc(N2CCOCC2)c2c(n1)c1COC(Cc1s2)(C)C

STK611375
Synonyms: 2-[(E)-2-(2-methoxyphenyl)ethenyl]-4-(phenylsulfonyl)-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine
Smiles: COc1ccccc1/C=C/c1oc(c(n1)S(=O)(=O)c1ccccc1)NCc1cccnc1

STK611376
Synonyms: (4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2cccc(c2)[N+](=O)[O-])N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)/O

STK611377
Synonyms: 1-(4-hydroxy-5,6,7,8-tetrahydroquinazolin-2-yl)-3-phenylguanidine
Smiles: N=C(Nc1nc(O)c2c(n1)CCCC2)Nc1ccccc1

STK611378
Synonyms: 3-hydroxy-5-(2-methoxyphenyl)-1-[3-(morpholin-4-yl)propyl]-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccccc1C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)/C=C/c1ccccc1)O

STK611379
Synonyms: N-benzyl-5,7-dimethyl-4-oxo-N-(pyridin-2-yl)-4H-chromene-2-carboxamide
Smiles: Cc1cc(C)c2c(c1)oc(cc2=O)C(=O)N(c1ccccn1)Cc1ccccc1

STK611381
Synonyms: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)-5-(5-methylfuran-2-yl)pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccc(o2)C)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STK611383
Synonyms: 2-ethyl-4-[2-(3-fluoro-4-methoxyphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Smiles: CCC1Oc2ccccc2C(=O)N(C1=O)CC(=O)c1ccc(c(c1)F)OC

STK611386
Synonyms: 3-{3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-2-hydroxyquinazolin-4(3H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)CCn1c(O)nc2c(c1=O)cccc2

STK611387
Synonyms: 3-[(2-chlorophenyl)amino]-6-methyl-1,2,4-triazin-5-ol
Smiles: Clc1ccccc1Nc1nnc(c(n1)O)C

STK611388
Synonyms: N-[(E)-(2-methylphenyl)methylidene]-4H-1,2,4-triazol-4-amine
Smiles: Cc1ccccc1/C=N/n1cnnc1

STK611389
Synonyms: N-[3-oxo-3-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)propyl]-2-phenoxyacetamide
Smiles: O=C(COc1ccccc1)NCCC(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK611390
Synonyms: tert-butyl2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCn1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)(C)C

STK611392
Synonyms: 11-(3-chloro-4-methoxyphenyl)-3-(tetrahydrofuran-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccc(cc1Cl)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)CC1CCCO1

STK611393
Synonyms: 1-(2-methoxyphenyl)-3-(2-methylpropyl)tetrahydro-1H-thieno[3,4-d]imidazole-2(3H)-thione5,5-dioxide
Smiles: COc1ccccc1N1C2CS(=O)(=O)CC2N(C1=S)CC(C)C

STK611394
Synonyms: 3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)-N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)propanamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C

STK611395
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-3-(2-hydroxy-3-methylphenyl)-1H-pyrazole-5-carboxamide
Smiles: O=C(c1[nH]nc(c1)c1cccc(c1O)C)NCc1ccc2c(c1)OCO2

STK611397
Synonyms: (4E)-1-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-5-(furan-2-yl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccco1)CC(c1cccs1)N(C)C)/c1ccccc1

STK611398
Synonyms: 10-(3-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(4-methylphenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: Cc1ccc(cc1)c1c2c(=O)n(C)c(=O)n(c2c2n1C(C)(C)COC2c1cccc(c1)O)C

STK611399
Synonyms: (2Z)-6-benzyl-2-[4-(trifluoromethyl)benzylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Smiles: O=c1nc2s/c(=C\c3ccc(cc3)C(F)(F)F)/c(=O)n2nc1Cc1ccccc1

STK611400
Synonyms: ethyl1-(3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C(CC)C

STK611401
Synonyms: {4-bromo-2-[(diphenylphosphoryl)methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccc(cc1CP(=O)(c1ccccc1)c1ccccc1)Br

STK611404
Synonyms: methyl(4-{(Z)-[1-(3,4-dimethylphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-2-methoxyphenoxy)acetate
Smiles: COC(=O)COc1ccc(cc1OC)/C=C\1/C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)O

STK611406
Synonyms: N-(1-benzyl-3-cyano-4,5-dimethyl-1H-pyrrol-2-yl)-2-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide
Smiles: N#Cc1c(C)c(n(c1NC(=O)Cc1nc2n(n1)c(C)cc(n2)C)Cc1ccccc1)C

STK611407
Synonyms: 2-[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]-N-(pyridin-3-ylmethyl)propanamide
Smiles: CC(C(=O)NCc1cccnc1)Oc1ccc2c(c1)oc(=O)c1c2cccc1

STK611410
Synonyms: N-(3-hydroxypropyl)-2-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetamide
Smiles: OCCCNC(=O)COc1ccc2c(c1)oc(=O)cc2C

STK611411
Synonyms: 7'-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]-6'-methyl-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-8'-one
Smiles: OC1CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2

STK611413
Synonyms: 4-methoxy-N-{(4E)-2-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-4H-chromen-4-ylidene}aniline
Smiles: COc1ccc(cc1CN1CCOCC1)c1c/c(=N\c2ccc(cc2)OC)/c2c(o1)cccc2

STK611414
Synonyms: 2-(1-methyl-2,4-dioxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl)-N-(tetrahydrofuran-2-ylmethyl)acetamide
Smiles: O=C(Cn1c(=O)c2c3CCCCc3sc2n(c1=O)C)NCC1CCCO1

STK611415
Synonyms: ethyl3-[9-(1,3-benzodioxol-5-yl)-4-methyl-2-oxo-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-3-yl]propanoate
Smiles: CCOC(=O)CCc1c(=O)oc2c(c1C)ccc1c2CN(CO1)c1ccc2c(c1)OCO2

STK611418
Synonyms: 2-[(1Z,3R)-1-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-5-methyl-2-oxohexan-3-yl]-1H-isoindole-1,3(2H)-dione
Smiles: CC(C[C@@H](N1C(=O)c2c(C1=O)cccc2)C(=O)/C=C/1\NCCc2c1cc1OCOc1c2)C

STK611419
Synonyms: (2E)-3-[2-(4-benzylpiperidin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1c(nc2n(c1=O)cccc2C)N1CCC(CC1)Cc1ccccc1)/S(=O)(=O)c1ccccc1

STK611420
Synonyms: N-(3-methoxypropyl)-7,7-dimethyl-2-(methylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-amine
Smiles: COCCCNc1nc(SC)nc2c1sc1c2COC(C1)(C)C

STK611421
Synonyms: N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-2-[(5Z)-5-(4-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-methylacetamide
Smiles: COc1ccc(cc1)/C=C/1\SC(=O)N(C1=O)CC(=O)N(CC(c1ccc(cc1)O)O)C

STK611422
Synonyms: 2-(benzylamino)-3-(3-methoxyphenyl)-5-methylfuro[3,2-c]quinolin-4(5H)-one
Smiles: COc1cccc(c1)c1c(NCc2ccccc2)oc2c1c(=O)n(c1c2cccc1)C

STK611423
Synonyms: (2Z)-7-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-4-methyl-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])cc(c2c1O/C(=C\c1ccncc1)/C2=O)C

STK611425
Synonyms: hexyl(4-hydroxy-6-methyl-2-phenylpyrimidin-5-yl)acetate
Smiles: CCCCCCOC(=O)Cc1c(C)nc(nc1O)c1ccccc1

STK611426
Synonyms: 3-methoxy-N-(pyridin-3-ylmethyl)-N-[2-(pyrrolidin-1-ylsulfonyl)ethyl]benzamide
Smiles: COc1cccc(c1)C(=O)N(Cc1cccnc1)CCS(=O)(=O)N1CCCC1

STK611427
Synonyms: 1-(4-bromo-2-chlorophenyl)tetrahydro-1H-thieno[3,4-d]imidazole-2(3H)-thione5,5-dioxide
Smiles: Brc1ccc(c(c1)Cl)N1C(=S)NC2C1CS(=O)(=O)C2

STK611428
Synonyms: 2-{[(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]amino}benzamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C(C)(C)C)Nc1ccccc1C(=O)N

STK611430
Synonyms: (4E)-5-(3-bromophenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(dimethylamino)propyl]pyrrolidine-2,3-dione
Smiles: CN(CCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1cccc(c1)Br)C

STK611431
Synonyms: (5Z)-1-(3-bromophenyl)-2-hydroxy-5-{[5-(pyrrolidin-1-yl)furan-2-yl]methylidene}pyrimidine-4,6(1H,5H)-dione
Smiles: Brc1cccc(c1)N1C(=NC(=O)/C(=C/c2ccc(o2)N2CCCC2)/C1=O)O

STK611432
Synonyms: 5-(2-bromo-5-nitrophenyl)-6-cyclopentyl-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: [O-][N+](=O)c1ccc(c(c1)c1n(cc2c1c(=O)n(C)c(=O)n2C)C1CCCC1)Br

STK611433
Synonyms: N-(2,1,3-benzoxadiazol-4-yl)-3-[(5Z)-5-(2-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanamide
Smiles: O=C(Nc1cccc2c1non2)CCN1C(=S)S/C(=C\c2ccccc2F)/C1=O

STK611435
Synonyms: 3-cyclopropyl-10-methyl-6-phenyl-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c(c1)c1ccccc1)C1CC1

STK611436
Synonyms: ethyl3-({[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-4-yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2

STK611437
Synonyms: 3-benzyl-6-chloro-9-(3-hydroxypropyl)-4-methyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: OCCCN1COc2c(C1)c1oc(=O)c(c(c1cc2Cl)C)Cc1ccccc1

STK611438
Synonyms: 4-bromo-N-[(2Z)-5-(methylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: O=C(c1ccc(cc1)Br)/N=c\1/[nH]nc(s1)S(=O)(=O)C

STK611439
Synonyms: 3,4-dimethyl-9-(propan-2-yl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: CC(N1COc2c(C1)c1oc(=O)c(c(c1cc2)C)C)C

STK611440
Synonyms: (5Z)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Fc1ccc(cc1)c1ccc(o1)/C=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O

STK611441
Synonyms: (5Z)-6-hydroxy-5-{1-[(4-methylpiperazin-1-yl)amino]ethylidene}-3-phenylpyrimidine-2,4(3H,5H)-dione
Smiles: CN1CCN(CC1)N/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1)O)/C

STK611443
Synonyms: 3-{2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl}-4-methyl-2-oxo-2H-chromene-7,8-diyldiacetate
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2OC(=O)C)OC(=O)C)NCc1ccc2c(c1)OCO2

STK611444
Synonyms: (4E)-1-[3-(dimethylamino)propyl]-4-[hydroxy(phenyl)methylidene]-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1CCCN(C)C

STK611445
Synonyms: 4-butyl-N-{5-[(2-fluorobenzyl)sulfonyl]-1,3,4-thiadiazol-2-yl}cyclohexanecarboxamide
Smiles: CCCCC1CCC(CC1)C(=O)Nc1nnc(s1)S(=O)(=O)Cc1ccccc1F

STK611447
Synonyms: 1-(2-fluorophenyl)-6-methoxy-2-(1,3-thiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)c1nccs1)c1ccccc1F

STK611448
Synonyms: (5Z)-5-[(2E)-3-(2,5-dimethoxyphenyl)-1-hydroxyprop-2-en-1-ylidene]-6-hydroxy-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C(\C=C\c2cc(OC)ccc2OC)/O)/C1=O)O

STK611449
Synonyms: (3S)-N-{2-[(2-methoxybenzyl)amino]-2-oxoethyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: COc1ccccc1CNC(=O)CNC(=O)[C@H]1NCc2c(C1)cccc2

STK611450
Synonyms: 4-methoxy-N-[1-oxo-1-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)propan-2-yl]benzamide
Smiles: COc1ccc(cc1)C(=O)NC(C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1)C

STK611451
Synonyms: N-[7,7-dimethyl-2-(propylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]propane-1,3-diamine
Smiles: CCCSc1nc(NCCCN)c2c(n1)c1COC(Cc1s2)(C)C

STK611452
Synonyms: (4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-5-(5-methylfuran-2-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(o1)C)c1sc2c(n1)c(C)cc(c2)C)/O

STK611453
Synonyms: 2-(4,6-dimethylpyrimidin-2-yl)-4-hydroxy-6-methyl-5-(naphthalen-1-ylmethyl)-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: Cc1cc(C)nc(n1)n1[nH]c2c(c1=O)c(O)c(c(n2)C)Cc1cccc2c1cccc2

STK611454
Synonyms: 2-(hydroxymethyl)-5-(4-methoxyphenyl)-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: OCn1nc(n(c1=S)CC=C)c1ccc(cc1)OC

STK611455
Synonyms: (5E)-3-cyclohexyl-6-hydroxy-5-[({3-[5-(hydroxymethyl)furan-2-yl]phenyl}amino)methylidene]pyrimidine-2,4(3H,5H)-dione
Smiles: OCc1ccc(o1)c1cccc(c1)N/C=C/1\C(=NC(=O)N(C1=O)C1CCCCC1)O

STK611457
Synonyms: N-(2,4-dimethoxyphenyl)-4-[(2-hydroxy-4-oxoquinazolin-3(4H)-yl)methyl]cyclohexanecarboxamide
Smiles: COc1cc(OC)ccc1NC(=O)C1CCC(CC1)Cn1c(O)nc2c(c1=O)cccc2

STK611462
Synonyms: 2-[(3-methylbut-2-en-1-yl)sulfanyl]-1-phenyl-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole5,5-dioxide
Smiles: CC(=CCSC1=NC2C(N1c1ccccc1)CS(=O)(=O)C2)C

STK611463
Synonyms: 1-(4-ethylpiperazin-1-yl)-3-(1H-indol-3-yl)propan-1-one
Smiles: CCN1CCN(CC1)C(=O)CCc1c[nH]c2c1cccc2

STK611464
Synonyms: (4E)-4-[1-benzofuran-2-yl(hydroxy)methylidene]-1-[3-(morpholin-4-yl)propyl]-5-(pyridin-2-yl)pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2cc3c(o2)cccc3)/O)/C(N1CCCN1CCOCC1)c1ccccn1

STK611465
Synonyms: 6-cyclopentyl-2-hydroxy-1-(4-methoxybenzyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)Cn1c(O)nc(=O)c2c1NCN(C2)C1CCCC1

STK611466
Synonyms: 2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-(4-fluorophenyl)acetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)Nc1ccc(cc1)F

STK611468
Synonyms: 3-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-7-methoxy-4,8-dimethyl-2H-chromen-2-one
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)N1CCN(CC1)c1cccc(c1C)C

STK611470
Synonyms: (2-bromo-5-ethyl-1-benzofuran-3-yl)aceticacid
Smiles: CCc1ccc2c(c1)c(CC(=O)O)c(o2)Br

STK611471
Synonyms: 1-[(4-methoxyphenyl)sulfonyl]-N-[3-oxo-3-(1,3-thiazol-2-ylamino)propyl]piperidine-4-carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NCCC(=O)Nc1nccs1

STK611472
Synonyms: 1-(2,4-dimethylphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1ccc(c(c1)C)n1ncc2c1ncnc2N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

STK611476
Synonyms: 3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[(3-ethoxypropyl)amino]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCN1C(=S)S/C(=C\c2c(NCCCOCC)nc3n(c2=O)cccc3C)/C1=O

STK611477
Synonyms: 6-(2-chlorobenzyl)-2-hydroxy-1-(2-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Clc1ccccc1CN1CNc2c(C1)c(=O)nc(n2CCc1ccccc1)O

STK611479
Synonyms: 1-(3,4-dimethylphenyl)-3-[(2Z)-5-(2-phenylethyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: O=C(/N=c\1/[nH]nc(s1)CCc1ccccc1)Nc1ccc(c(c1)C)C

STK611481
Synonyms: 1-(3-iodophenyl)-2-(4-nitrophenyl)-1H-imidazo[4,5-b]quinoxaline
Smiles: Ic1cccc(c1)n1c(nc2c1nc1ccccc1n2)c1ccc(cc1)[N+](=O)[O-]

STK611484
Synonyms: 2-(2-hydroxy-6,6-dimethyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(6H)-yl)-N-(3-methoxypropyl)acetamide
Smiles: COCCCNC(=O)Cn1c(O)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK611485
Synonyms: 1-(3,3-dimethyl-2-oxobutyl)-4-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
Smiles: O=C1CN(C)C(=O)c2c(N1CC(=O)C(C)(C)C)cccc2

STK611487
Synonyms: 2-(benzylsulfanyl)-5-(4-ethoxybenzyl)-6-methylpyrimidin-4-ol
Smiles: CCOc1ccc(cc1)Cc1c(C)nc(nc1O)SCc1ccccc1

STK611489
Synonyms: 3-cyclohexyl-5,6-dimethyl-7-[3-(morpholin-4-yl)propyl]-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-imine
Smiles: Cc1c(C)n(c2c1c(=N)n(cn2)C1CCCCC1)CCCN1CCOCC1

STK611490
Synonyms: 4-bromo-N'-{(E)-[3-(4-bromobenzyl)-4-chloro-2-oxo-2,3-dihydro-1,3-thiazol-5-yl]methylidene}benzohydrazide
Smiles: Brc1ccc(cc1)Cn1c(=O)sc(c1Cl)/C=N/NC(=O)c1ccc(cc1)Br

STK611491
Synonyms: 4-methyl-9-(2,2,6,6-tetramethylpiperidin-4-yl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: O=c1cc(C)c2c(o1)c1CN(COc1cc2)C1CC(C)(C)NC(C1)(C)C

STK611492
Synonyms: (5E)-5-{4-[3-(2,5-dimethylphenoxy)propoxy]-3-methoxybenzylidene}-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(ccc1OCCCOc1cc(C)ccc1C)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccco1)O

STK611494
Synonyms: 5-(4-tert-butylphenyl)-10-(2,5-dihydroxyphenyl)-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: Oc1ccc(c(c1)C1OCCn2c1c1c(c2c2ccc(cc2)C(C)(C)C)c(=O)n(c(=O)n1C)C)O

STK611497
Synonyms: (3E)-3-(1-aminoethylidene)-2-ethyl-2,3-dihydro-4H-1,2-benzothiazin-4-one1,1-dioxide
Smiles: CCN1/C(=C(/N)\C)/C(=O)c2c(S1(=O)=O)cccc2

STK611498
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetamide
Smiles: O=C(Cn1nnc2c(c1=O)cccc2)Nc1ccc(c(c1)C(F)(F)F)Cl

STK611500
Synonyms: N-[4-(acetylamino)phenyl]-2-(6'-methyl-8'-oxo-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-7'-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2)Nc1ccc(cc1)NC(=O)C

STK611503
Synonyms: N-{(2S)-1-oxo-3-phenyl-1-[(2-phenylethyl)amino]propan-2-yl}-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: O=C([C@@H](NC(=O)N1CCn2c1nc1c2cccc1)Cc1ccccc1)NCCc1ccccc1

STK611504
Synonyms: 2,2'-{[3-(2-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]imino}diethanol
Smiles: OCCN(c1ccc2n(n1)c(nn2)c1ccccc1Cl)CCO

STK611509
Synonyms: 2-(2-hydroxy-6,6-dimethyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(6H)-yl)-N-(2-methoxyethyl)acetamide
Smiles: COCCNC(=O)Cn1c(O)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK611510
Synonyms: 5-(3,4-dimethoxyphenyl)-4-hydroxy-2-phenyl-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one
Smiles: COc1ccc(cc1OC)C1CC(=O)Nc2c1c(O)nc(n2)c1ccccc1

STK611511
Synonyms: methyl(1-benzyl-6,6-dimethyl-2,4-dioxo-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)acetate
Smiles: COC(=O)Cn1c(=O)n(Cc2ccccc2)c2c(c1=O)c1CC(C)(C)OCc1s2

STK611513
Synonyms: 2-(2-hydroxy-6,6-dimethyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(6H)-yl)-N-(3-methylbutyl)acetamide
Smiles: CC(CCNC(=O)Cn1c(O)nc2c(c1=O)c1CC(C)(C)OCc1s2)C

STK611515
Synonyms: 1,3-dimethyl-3'-phenyl-2-thioxo-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-4,6(1H,3H)-dione
Smiles: S=C1N(C)C(=O)C2(C(=O)N1C)Cc1ccccc1N1C2C(CC1)c1ccccc1

STK611517
Synonyms: ethyl3-[6,10-dimethyl-8-oxo-3-(pyridin-3-ylmethyl)-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-7-yl]propanoate
Smiles: CCOC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)OCN(C1)Cc1cccnc1

STK611519
Synonyms: (4E)-1-[3-(dimethylamino)propyl]-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CN(CCCN1C(c2ccc(cc2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\O)/C(=O)C1=O)C

STK611520
Synonyms: 2-{4-[4-cyano-1-(2-methylpropyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl]piperazin-1-yl}acetamide
Smiles: N#Cc1c(nc(c2c1CCC2)CC(C)C)N1CCN(CC1)CC(=O)N

STK611521
Synonyms: N'-(2-{2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]tetrahydro-2H-pyran-4-yl}ethyl)-N,N-dimethylpropane-1,3-diamine
Smiles: CN(CCCNCCC1(CCOC(C1)(C)C)c1cccc(c1)C(F)(F)F)C

STK611522
Synonyms: 1-(3-chlorophenyl)-3-[(2Z)-5-(4-nitrophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: Clc1cccc(c1)NC(=O)/N=c\1/[nH]nc(s1)c1ccc(cc1)[N+](=O)[O-]

STK611525
Synonyms: 3-(4-chlorophenyl)-N-[3-(morpholin-4-yl)propyl]-3-phenylpropan-1-amine
Smiles: Clc1ccc(cc1)C(c1ccccc1)CCNCCCN1CCOCC1

STK611527
Synonyms: 2-[6,6-dimethyl-2,4-dioxo-1-(propan-2-yl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl]-N-(tetrahydrofuran-2-ylmethyl)acetamide
Smiles: O=C(Cn1c(=O)c2c3CC(C)(C)OCc3sc2n(c1=O)C(C)C)NCC1CCCO1

STK611528
Synonyms: 2-[3-{2-[(4-fluorophenyl)amino]-2-oxoethyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(3-methylbutyl)acetamide
Smiles: CC(CCNC(=O)Cn1c(=O)n(CC(=O)Nc2ccc(cc2)F)c(=O)c2c1ccs2)C

STK611529
Synonyms: 6'-hydroxy-7,9,9-trimethyl-3-nitro-3'-(propan-2-yl)-6a,7,8,9,10,11-hexahydro-2'H,5H-spiro[7,11-methanoazepino[1,2-a]quinoline-6,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: CC(N1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N1C2C2(C)CC1CC(C2)(C)C)[N+](=O)[O-])O)C

STK611530
Synonyms: 3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4,8-dimethyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-chromen-2-one
Smiles: CC(=C)COc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)N1CCN(CC1)c1ccc(cc1)F

STK611533
Synonyms: 4-methyl-9-(3-methylbutyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: CC(CCN1COc2c(C1)c1oc(=O)cc(c1cc2)C)C

STK611534
Synonyms: 3-benzyl-9-(2-methoxyethyl)-4-methyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: COCCN1COc2c(C1)c1oc(=O)c(c(c1cc2)C)Cc1ccccc1

STK611535
Synonyms: (4E)-5-(4-chlorophenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(thiophen-2-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)Cl)/C(=C(/c2cccs2)\O)/C(=O)C1=O

STK611536
Synonyms: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl)piperazin-1-yl]-N-(4-methoxyphenyl)acetamide
Smiles: N#Cc1c(nc(c2c1CCC2)c1ccccc1)N1CCN(CC1)CC(=O)Nc1ccc(cc1)OC

STK611537
Synonyms: 1',3,3'-trimethyl-8-nitro-2'-thioxo-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H,3'H)-dione
Smiles: CC1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N(C)C(=S)N(C1=O)C

STK611538
Synonyms: 1-phenyl-3-[(tetrahydrofuran-2-ylmethyl)amino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(NCC2CCCO2)nc(c2c1CCCC2)c1ccccc1

STK611541
Synonyms: N-[2-(4-chlorophenyl)ethyl]-1-(9H-purin-6-yl)piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1ncnc2c1nc[nH]2)NCCc1ccc(cc1)Cl

STK611542
Synonyms: 8-bromo-6-hydroxy-3-methyl-7-{3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propyl}-3,7-dihydro-2H-purin-2-one
Smiles: Cc1nnc(s1)SCCCn1c(Br)nc2c1c(O)nc(=O)n2C

STK611543
Synonyms: 4-[5-(2,3-dimethoxyphenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: COc1cc(ccc1OC)C1=NN(C(C1)c1cccc(c1OC)OC)C(=O)CCC(=O)O

STK611545
Synonyms: N-(5,7-diphenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-4-methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1nc2n(n1)C(C=C(N2)c1ccccc1)c1ccccc1

STK611547
Synonyms: (5E)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cc(n(c2C)c2ccc(cc2)Cl)C)/C1=O)O

STK611548
Synonyms: 3-amino-6-(1,3-benzodioxol-5-yl)-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)ccc(n2)c1ccc2c(c1)OCO2)NC12CC3CC(C2)CC(C1)C3

STK611549
Synonyms: 2-(4-chlorophenyl)-N-[(2E)-3-(4-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccc(cc1)F)CS(=O)(=O)C2)Cc1ccc(cc1)Cl

STK611550
Synonyms: 3-hydroxy-N-(3-{[2-(4-methoxyphenyl)ethyl]amino}-3-oxopropyl)quinoxaline-1(2H)-carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)CCNC(=O)N1CC(=Nc2c1cccc2)O

STK611554
Synonyms: methyl2-{(3E)-3-[hydroxy(phenyl)methylidene]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)C(C)C

STK611555
Synonyms: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N'-[2-(3,4-dimethoxyphenyl)ethyl]ethanediamide
Smiles: COc1cc(CCNC(=O)C(=O)Nc2sc3c(c2C#N)CCCC3)ccc1OC

STK611556
Synonyms: N-{4-[(4-bromo-2-methylphenyl)amino]-4-oxobutyl}-3-hydroxyquinoxaline-1(2H)-carboxamide
Smiles: O=C(Nc1ccc(cc1C)Br)CCCNC(=O)N1CC(=Nc2c1cccc2)O

STK611557
Synonyms: 1-(3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Smiles: COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCC(CC2)C(=O)N)/C1=O

STK611558
Synonyms: 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)COc1cc3oc(=O)c4c(c3cc1Cl)CCC4)c[nH]2

STK611559
Synonyms: 1-[3-(4-fluorophenyl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-phenoxyethanone
Smiles: Fc1ccc(cc1)c1n[nH]c2c1CN(CC2)C(=O)COc1ccccc1

STK611561
Synonyms: N-(2-bromophenyl)-1-(4-chlorophenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Clc1ccc(cc1)n1ccc(=O)c(n1)C(=O)Nc1ccccc1Br

STK611563
Synonyms: N-(3,5-dimethoxyphenyl)-2-[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]acetamide
Smiles: COc1cc(NC(=O)COc2ccc3c(c2)oc(=O)c2c3cccc2)cc(c1)OC

STK611566
Synonyms: (4E)-1-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-4-[hydroxy(phenyl)methylidene]-5-(pyridin-4-yl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccncc1)CC(c1cccs1)N(C)C)/c1ccccc1

STK611567
Synonyms: 5-ethyl-N-{(2S)-1-[(3-methoxypropyl)amino]-3-methyl-1-oxobutan-2-yl}-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: COCCCNC(=O)[C@H](C(C)C)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1

STK611568
Synonyms: N-(2,4-dimethoxyphenyl)-2-[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]acetamide
Smiles: COc1cc(OC)ccc1NC(=O)COc1ccc2c(c1)oc(=O)c1c2cccc1

STK611569
Synonyms: 7-[(1-{4-[bis(4-fluorophenyl)methyl]piperazin-1-yl}-1-oxopropan-2-yl)oxy]-2H-chromen-2-one
Smiles: Fc1ccc(cc1)C(c1ccc(cc1)F)N1CCN(CC1)C(=O)C(Oc1ccc2c(c1)oc(=O)cc2)C

STK611570
Synonyms: 2-[4-(4-chlorophenyl)piperazin-1-yl]-5-ethyl-6-methylpyrimidin-4-ol
Smiles: CCc1c(C)nc(nc1O)N1CCN(CC1)c1ccc(cc1)Cl

STK611572
Synonyms: (4E)-4-[(3,4-dimethoxyphenyl)(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1OC)/C(=C\1/C(c2ccc(cc2)C(C)C)N(C(=O)C1=O)c1noc(c1)C)/O

STK611575
Synonyms: (2S)-N-(3-acetylphenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: O=C([C@@H](n1c(O)nc2c(c1=O)cccc2)C)Nc1cccc(c1)C(=O)C

STK611576
Synonyms: (5Z)-5-(furan-2-ylmethylidene)-3-{1-[2-(2-hydroxyethyl)piperidin-1-yl]-1-oxopropan-2-yl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: OCCC1CCCCN1C(=O)C(N1C(=S)S/C(=C\c2ccco2)/C1=O)C

STK611578
Synonyms: methyl{2,4-dioxo-1-[2-(piperidin-1-yl)ethyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl}acetate
Smiles: COC(=O)Cn1c(=O)c2c3CCCc3sc2n(c1=O)CCN1CCCCC1

STK611579
Synonyms: 5-methyl-2-(phenylamino)-3-(pyridin-2-yl)furo[3,2-c]quinolin-4(5H)-one
Smiles: O=c1c2c(c3ccccn3)c(oc2c2c(n1C)cccc2)Nc1ccccc1

STK611581
Synonyms: 4-tert-butyl-N-[2-oxo-2-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)ethyl]benzamide
Smiles: O=C(N1CCC2(CC1)NCCc1c2[nH]cn1)CNC(=O)c1ccc(cc1)C(C)(C)C

STK611583
Synonyms: (3R)-N-[(2S)-1-(cyclohexylamino)-3-methyl-1-oxobutan-2-yl]-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: CC([C@@H](C(=O)NC1CCCCC1)NC(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1)C

STK611584
Synonyms: 11-benzyl-2-methyl-3-(2-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1nc2c(c(=O)n1CCc1ccccc1)c1c(n2Cc2ccccc2)nc2c(n1)cccc2

STK611585
Synonyms: 2-{(2Z)-2-[(2E)-benzylidenehydrazinylidene]-4-oxo-1,3-thiazolidin-5-yl}-N-(3,5-dichlorophenyl)acetamide
Smiles: O=C(CC1S/C(=N\N=C\c2ccccc2)/NC1=O)Nc1cc(Cl)cc(c1)Cl

STK611586
Synonyms: (5Z)-5-(3,5-dibromo-2-methoxybenzylidene)-3-(4-fluorobenzyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1c(cc(cc1Br)Br)/C=C\1/C(=NC(=O)N(C1=O)Cc1ccc(cc1)F)O

STK611587
Synonyms: N-{2-[({trans-4-[(furan-2-ylmethyl)carbamoyl]cyclohexyl}methyl)amino]-2-oxoethyl}benzamide
Smiles: O=C(CNC(=O)c1ccccc1)NC[C@@H]1CC[C@H](CC1)C(=O)NCc1ccco1

STK611589
Synonyms: 11-(4-chloro-3-nitrophenyl)-3-(tetrahydrofuran-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: [O-][N+](=O)c1cc(ccc1Cl)n1c2nc3ccccc3nc2c2c1ncn(c2=O)CC1CCCO1

STK611590
Synonyms: benzyl{[1-(3-chloro-4-fluorophenyl)-5,5-dioxido-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl]sulfanyl}acetate
Smiles: O=C(CSC1=NC2C(N1c1ccc(c(c1)Cl)F)CS(=O)(=O)C2)OCc1ccccc1

STK611593
Synonyms: (5E)-5-{[1-(4-bromobenzyl)-2-methyl-1H-indol-3-yl]methylidene}-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C\c2c3ccccc3n(c2C)Cc2ccc(cc2)Br)/C1=O)O

STK611594
Synonyms: (4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-phenyl-1-(pyridin-4-ylmethyl)pyrrolidine-2,3-dione
Smiles: Cc1cccc(c1)COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)Cc1ccncc1)/O

STK611595
Synonyms: (3Z)-1-(3-chlorophenyl)-3-(pyridin-3-ylmethylidene)pyrrolidine-2,5-dione
Smiles: Clc1cccc(c1)N1C(=O)C/C(=C/c2cccnc2)/C1=O

STK611596
Synonyms: 2-(1,3-benzothiazol-2-yl)-N-(3-methylpyridin-2-yl)pyridine-3-carboxamide
Smiles: O=C(c1cccnc1c1nc2c(s1)cccc2)Nc1ncccc1C

STK611597
Synonyms: 1-[(2E)-5-butyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylurea
Smiles: CCCCc1n[nH]/c(=N\C(=O)Nc2ccccc2)/s1

STK611598
Synonyms: (5E)-1-(4-ethoxyphenyl)-5-({[2-(piperazin-1-yl)ethyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=NC(=O)/C(=C\NCCN2CCNCC2)/C1=O)S

STK611599
Synonyms: 4-hydroxy-1,6,7-trimethyl-8-[2-(4-methylpiperazin-1-yl)ethyl]-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: CN1CCN(CC1)CCn1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK611601
Synonyms: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(morpholin-4-yl)propyl]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])CCCN1CCOCC1)/c1ccc2c(c1)OCCO2

STK611603
Synonyms: (7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)(4-phenylpiperazin-1-yl)methanone
Smiles: Cc1cc(O)n2c(n1)nc(n2)C(=O)N1CCN(CC1)c1ccccc1

STK611607
Synonyms: (3R)-2,2-dimethyl-N-{(2S)-3-methyl-1-oxo-1-[(pyridin-4-ylmethyl)amino]butan-2-yl}-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: CC([C@@H](C(=O)NCc1ccncc1)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C

STK611609
Synonyms: 3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-chromen-2-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)ccc(c2)OCC(=C)C

STK611611
Synonyms: 2-chloro-5-[({[4-methyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: O=C(Nc1ccc(c(c1)C(=O)O)Cl)CSc1nnc(n1C)c1cnccn1

STK611612
Synonyms: N-(2,6-dimethylphenyl)-2-(4-methyl-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-1-yl)acetamide
Smiles: O=C(CN1C(=O)CN(C(=O)c2c1cccc2)C)Nc1c(C)cccc1C

STK611613
Synonyms: N-[(2Z)-4-(4-chlorophenyl)-1,3-thiazol-2(3H)-ylidene]-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide
Smiles: COc1ccccc1N1CCN(CC1)CC(=O)/N=c/1\scc([nH]1)c1ccc(cc1)Cl

STK611615
Synonyms: 7-amino-2,4-dihydroxy-5-(3-nitrophenyl)-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)[N+](=O)[O-])c(O)nc(n2)O

STK611617
Synonyms: 2-{[7,7-dimethyl-2-(methylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl]sulfanyl}acetamide
Smiles: CSc1nc(SCC(=O)N)c2c(n1)c1COC(Cc1s2)(C)C

STK611618
Synonyms: [5-(2-chloro-7-methoxyquinolin-3-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl](2-fluorophenyl)methanone
Smiles: COc1ccc2c(c1)nc(c(c2)C1CC(=NN1C(=O)c1ccccc1F)c1ccc(cc1)C)Cl

STK611619
Synonyms: (5E)-6-hydroxy-5-(4-hydroxy-3-methoxybenzylidene)-3-[4-(propan-2-yl)phenyl]pyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(ccc1O)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)C(C)C)O

STK611621
Synonyms: 2-(2-phenyl-1,3-thiazol-4-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Smiles: O=C(Cc1csc(n1)c1ccccc1)NCCc1ccc(cc1)S(=O)(=O)N

STK611622
Synonyms: (3aS,6R,7aR)-2-(4-methoxyphenyl)-1-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: COc1ccc(cc1)N1C[C@@]23[C@H](C1=O)C([C@@H](O3)C=C2)C(=O)NC1CC(C)(C)NC(C1)(C)C

STK611623
Synonyms: 3-chloro-N-[2-oxo-2-(3,5,6,7-tetrahydro-1'H-spiro[imidazo[4,5-c]pyridine-4,4'-piperidin]-1'-yl)ethyl]benzamide
Smiles: Clc1cccc(c1)C(=O)NCC(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK611625
Synonyms: 10-(2-chloro-6-fluorobenzyl)-7-methyl-1,2,3,4,10,11-hexahydro-5H,9H-benzo[3,4]chromeno[6,7-e][1,3]oxazin-5-one
Smiles: Fc1cccc(c1CN1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCCC2)Cl

STK611626
Synonyms: N-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)ethyl]biphenyl-4-carboxamide
Smiles: O=C(c1ccc(cc1)c1ccccc1)NCCc1csc2=NCCn12

STK611627
Synonyms: (4E)-1-[3-(dimethylamino)propyl]-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CN(CCCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\O)/C(=O)C1=O)C

STK611629
Synonyms: (5Z)-1-(2-fluorophenyl)-5-{[5-(piperidin-1-yl)furan-2-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C\c1ccc(o1)N1CCCCC1)c1ccccc1F

STK611630
Synonyms: 4-chloro-2-(1-methyl-1H-benzimidazol-2-yl)-5-[(pyridin-2-ylmethyl)amino]pyridazin-3(2H)-one
Smiles: Clc1c(NCc2ccccn2)cnn(c1=O)c1nc2c(n1C)cccc2

STK611633
Synonyms: (4E)-5-[4-(dimethylamino)phenyl]-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(c2ccc(cc2)N(C)C)/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\O)/C(=O)C1=O

STK611636
Synonyms: N-{(2S)-1-[(furan-2-ylmethyl)amino]-3-methyl-1-oxobutan-2-yl}-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
Smiles: CC([C@@H](C(=O)NCc1ccco1)NC(=O)N1CCn2c1nc1c2cccc1)C

STK611637
Synonyms: 9-(3,5-difluorophenyl)-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Fc1cc(F)cc(c1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1

STK611638
Synonyms: (5E)-3-benzyl-6-hydroxy-5-{[2-(2-hydroxyethyl)hydrazinyl]methylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: OCCNN/C=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)O

STK611639
Synonyms: N-[(2E)-5,5-dioxido-3-(2-phenylethyl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide
Smiles: COc1ccc(cc1OC)C(=O)/N=C\1/SC2C(N1CCc1ccccc1)CS(=O)(=O)C2

STK611642
Synonyms: 3-[(3-methoxypropyl)amino]-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: COCCCNc1nc(C)c2c(c1C#N)CCCC2

STK611643
Synonyms: 3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-N-cyclohexyl-4,5-dihydro-1,2-oxazole-5-carboxamide
Smiles: COc1cc(ccc1OCC(=O)N)C1=NOC(C1)C(=O)NC1CCCCC1

STK611644
Synonyms: N-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-2,3-dimethoxybenzamide
Smiles: COc1cccc(c1OC)C(=O)NCc1cc(=O)n(c(=O)n1C)C

STK611645
Synonyms: 2-(4-chlorophenoxy)-N-(5-fluoro-9-oxo-9H-xanthen-3-yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)oc1c(c2=O)cccc1F)COc1ccc(cc1)Cl

STK611648
Synonyms: 3-[7-chloro-4-(2-methylpropyl)-3-oxo-3,4-dihydroquinoxalin-2-yl]-N-(4-sulfamoylphenyl)propanamide
Smiles: CC(Cn1c(=O)c(CCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nc2c1ccc(c2)Cl)C

STK611649
Synonyms: (3R)-2,2-dimethyl-5-oxo-N-[(2S)-1-oxo-3-phenyl-1-(1,3-thiazol-2-ylamino)propan-2-yl]-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1ccccc1)Nc1nccs1

STK611650
Synonyms: N-(2,4-dimethylphenyl)-11-(2-methoxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1C)C)c1ccccc1

STK611652
Synonyms: (2S)-N-(2-bromophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: Brc1ccccc1NC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)C

STK611658
Synonyms: 3,4-dimethoxy-N-{2-[2-(4-methoxyphenyl)-1H-imidazol-5-yl]ethyl}benzamide
Smiles: COc1ccc(cc1)c1ncc([nH]1)CCNC(=O)c1ccc(c(c1)OC)OC

STK611660
Synonyms: 1-(2-fluorophenyl)-2-hydroxy-6-(1-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CC(N1CNc2c(C1)c(=O)nc(n2c1ccccc1F)O)c1ccccc1

STK611662
Synonyms: 4-(4-methoxyphenyl)-9-[3-(2-oxopyrrolidin-1-yl)propyl]-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1ccc1c2CN(CO1)CCCN1CCCC1=O

STK611665
Synonyms: 12-chloro-3-[3-(1H-imidazol-1-yl)propyl]-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Smiles: Clc1cc2c(c3c1OCN(C3)CCCn1cncc1)oc(=O)c1c2CCCC1

STK611666
Synonyms: (4E)-5-(3-chlorophenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(pyrimidin-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)c1ncccn1)/O

STK611669
Synonyms: 5-[1-(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)-5-phenylpyrazolidin-3-ylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1C=C(CC(C1)(C)C)N1NC(=C2C(=O)N(C)C(=O)N(C2=O)C)CC1c1ccccc1

STK611670
Synonyms: 1-[(2Z)-5-{[(4-chlorobenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3,4-dichlorophenyl)urea
Smiles: Clc1ccc(cc1)CSCc1n[nH]/c(=N/C(=O)Nc2ccc(c(c2)Cl)Cl)/s1

STK611671
Synonyms: (4-{[1-(4-bromophenyl)-1H-tetrazol-5-yl]methoxy}phenyl)(phenyl)methanone
Smiles: Brc1ccc(cc1)n1nnnc1COc1ccc(cc1)C(=O)c1ccccc1

STK611672
Synonyms: 6-methoxy-2-(5-methyl-1,3,4-thiadiazol-2-yl)-1-[3-(propan-2-yloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)c1nnc(s1)C)c1cccc(c1)OC(C)C

STK611673
Synonyms: methyl3-{[(E)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]amino}-4-methoxy-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1N/C=C/1\C(=NC(=NC1=O)O)O)c(OC)ccc2

STK611675
Synonyms: 2-(cyclohex-3-en-1-yl)-4-(2,5-dimethylphenyl)-5-phenyl-1H-imidazole
Smiles: Cc1ccc(c(c1)c1nc([nH]c1c1ccccc1)C1CCC=CC1)C

STK611677
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-N'-(pyridin-2-ylmethyl)ethanediamide
Smiles: N#Cc1c(NC(=O)C(=O)NCc2ccccn2)sc2c1CCC2

STK611678
Synonyms: 3-{(5E)-5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-N-[3-(1H-imidazol-1-yl)propyl]propanamide
Smiles: O=C(CCN1C(=S)S/C(=C/C=C/c2ccco2)/C1=O)NCCCn1cncc1

STK611679
Synonyms: N-(1H-benzimidazol-2-yl)-2-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetamide
Smiles: CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)Nc1nc2c([nH]1)cccc2

STK611680
Synonyms: 1-(furan-2-yl)-3-[4-(phenylcarbonyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(nc(c2c1CCCC2)c1ccco1)N1CCN(CC1)C(=O)c1ccccc1

STK611681
Synonyms: N-{3-[(2-methylphenyl)amino]-3-oxopropyl}-1-(phenylsulfonyl)piperidine-4-carboxamide
Smiles: O=C(Nc1ccccc1C)CCNC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1

STK611684
Synonyms: 3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethoxy}-6H-benzo[c]chromen-6-one
Smiles: O=C(N1CCN(CC1)c1cccc(c1C)C)COc1ccc2c(c1)oc(=O)c1c2cccc1

STK611685
Synonyms: 2'-amino-6'-(hydroxymethyl)-2,8'-dioxo-1-(propan-2-yl)-1,2-dihydro-8'H-spiro[indole-3,4'-pyrano[3,2-b]pyran]-3'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)C(C)C)oc(cc2=O)CO

STK611686
Synonyms: (4E)-5-(2,5-dimethoxyphenyl)-1-[3-(dimethylamino)propyl]-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1C1N(CCCN(C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/O)OC

STK611687
Synonyms: (4E)-4-[(4-fluorophenyl)(hydroxy)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: Cc1ccc(cc1)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1c1noc(c1)C

STK611690
Synonyms: N-[2-(morpholin-4-yl)ethyl]-2-[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]acetamide
Smiles: O=C(COc1ccc2c(c1)oc(=O)c1c2cccc1)NCCN1CCOCC1

STK611691
Synonyms: N'-[(E)-(3-nitrophenyl)methylidene]-1-benzofuran-2-carbohydrazide
Smiles: O=C(c1cc2c(o1)cccc2)N/N=C/c1cccc(c1)[N+](=O)[O-]

STK611692
Synonyms: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(furan-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1c1ccc2c(c1)OCCO2)c1ccco1

STK611693
Synonyms: 1-(furan-2-ylmethyl)-2-hydroxy-6-propyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2Cc1ccco1)O

STK611696
Synonyms: methyl4-(5-{(E)-[1-(3,4-dimethylphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)c1ccc(o1)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)O

STK611697
Synonyms: 2,5-dichloro-N-(3-{[3-(trifluoromethyl)phenyl]amino}quinoxalin-2-yl)benzenesulfonamide
Smiles: Clc1ccc(c(c1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1cccc(c1)C(F)(F)F)Cl

STK611698
Synonyms: N~3~-{[4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl]methyl}-beta-alaninamide
Smiles: COc1ccc(cc1)C1(CCOCC1)CNCCC(=O)N

STK611699
Synonyms: 3-(1,3-benzothiazol-2-yl)-N-(2-ethoxyphenyl)pyrazine-2-carboxamide
Smiles: CCOc1ccccc1NC(=O)c1nccnc1c1nc2c(s1)cccc2

STK611700
Synonyms: ethyl3-(3-cyclopropyl-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-7-yl)propanoate
Smiles: CCOC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)OCN(C1)C1CC1

STK611703
Synonyms: (5E)-5-({[2-(1-benzylpiperidin-4-yl)ethyl]amino}methylidene)-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C\NCCC2CCN(CC2)Cc2ccccc2)/C1=O)O

STK611705
Synonyms: methyl4-[(3E)-3-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)-4,5-dioxopyrrolidin-2-yl]benzoate
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)C(=O)OC)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)/O

STK611706
Synonyms: 5-{[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl}-2-(3-methoxypropyl)-1H-isoindole-1,3(2H)-dione
Smiles: COCCCN1C(=O)c2c(C1=O)ccc(c2)C(=O)N1CCN(CC1)c1ccc(cc1)OC

STK611707
Synonyms: 5-{[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl}-2-(3-methoxypropyl)-1H-isoindole-1,3(2H)-dione
Smiles: COCCCN1C(=O)c2c(C1=O)ccc(c2)C(=O)N1CCN(CC1)c1ccccc1OC

STK611709
Synonyms: (2S)-N-(3,4-difluorophenyl)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanamide
Smiles: O=C([C@@H](n1c(O)nc2c(c1=O)cccc2)C)Nc1ccc(c(c1)F)F

STK611710
Synonyms: 2-[(6-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]-N-(pyridin-2-yl)acetamide
Smiles: O=C(Nc1ccccn1)COc1ccc2c(c1C)oc(=O)c1c2CCC1

STK611713
Synonyms: 6-(2-chlorobenzyl)-1-(2,3-dimethylphenyl)-2-hydroxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Oc1nc(=O)c2c(n1c1cccc(c1C)C)NCN(C2)Cc1ccccc1Cl

STK611715
Synonyms: 6-(2-chlorobenzyl)-1-(3,4-dimethylphenyl)-2-hydroxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1nc(O)n(c2c1CN(CN2)Cc1ccccc1Cl)c1ccc(c(c1)C)C

STK611716
Synonyms: 2-[(3-ethoxypropyl)amino]-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCOCCCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC=C

STK611718
Synonyms: N-{3-[(furan-2-ylmethyl)amino]-3-oxopropyl}-6,7-dimethoxy-1-phenyl-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: COc1cc2c(cc1OC)CCN(C2c1ccccc1)C(=O)NCCC(=O)NCc1ccco1

STK611719
Synonyms: (2E)-3-(1,3-benzodioxol-5-yl)-N-{2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]ethyl}prop-2-enamide
Smiles: COc1cccc(c1)c1scc(n1)CCNC(=O)/C=C/c1ccc2c(c1)OCO2

STK611721
Synonyms: 5-ethyl-8-oxo-N-{2-oxo-2-[(pyridin-3-ylmethyl)amino]ethyl}-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: CCn1cc(C(=O)NCC(=O)NCc2cccnc2)c(=O)c2c1cc1OCOc1c2

STK611722
Synonyms: N-[(2E)-5-[(2-fluorobenzyl)sulfonyl]-1,3,4-thiadiazol-2(3H)-ylidene]-4-methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)/N=c/1\[nH]nc(s1)S(=O)(=O)Cc1ccccc1F

STK611723
Synonyms: (4E)-5-(4-ethoxyphenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Smiles: COCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccc(cc1)OCC