FULL DB

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

STK780630
Synonyms: ethylN-tetrazolo[1,5-a]quinoxalin-4-ylglycinate
Smiles: CCOC(=O)CNc1nc2ccccc2n2c1nnn2

STK780631
Synonyms: ethylN-(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)glycinate
Smiles: CCOC(=O)CNc1nc2ccccc2n2c1nnc2C

STK780634
Synonyms: 2-amino-1-(3-chlorophenyl)-4-[4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2cccc(c2)Cl)C2=C(C1c1scc(c1)CN1CCOCC1)C(=O)CCC2

STK780635
Synonyms: 2-amino-1-(4-chlorophenyl)-4-[4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(cc2)Cl)C2=C(C1c1scc(c1)CN1CCOCC1)C(=O)CCC2

STK780636
Synonyms: 2-amino-1-(4-methoxyphenyl)-4-[4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1ccc(cc1)N1C(=C(C#N)C(C2=C1CCCC2=O)c1scc(c1)CN1CCOCC1)N

STK780637
Synonyms: 2-amino-4-[4-(morpholin-4-ylmethyl)thiophen-2-yl]-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCCC2)c1scc(c1)CN1CCOCC1)(C#N)C#N

STK780638
Synonyms: 6-amino-4-{4-[(1,3-benzothiazol-2-ylsulfanyl)methyl]thiophen-2-yl}-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1scc(c1)CSc1nc3c(s1)cccc3)c(C)[nH]n2

STK780640
Synonyms: methyl2-{[4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitrophenyl]carbonyl}benzoate
Smiles: COC(=O)c1ccccc1C(=O)c1ccc(c(c1)[N+](=O)[O-])Sc1nc2c(s1)cccc2

STK780641
Synonyms: 5-[(4-methylphenyl)sulfonyl]-4-nitro-2,1,3-benzothiadiazole
Smiles: Cc1ccc(cc1)S(=O)(=O)c1ccc2c(c1[N+](=O)[O-])nsn2

STK780643
Synonyms: 3,6-dichloro-2-methoxy-N-(morpholin-4-ylcarbonothioyl)benzamide
Smiles: COc1c(Cl)ccc(c1C(=O)NC(=S)N1CCOCC1)Cl

STK780644
Synonyms: (3,6-dichloro-2-methoxyphenyl)(morpholin-4-yl)methanone
Smiles: COc1c(Cl)ccc(c1C(=O)N1CCOCC1)Cl

STK780645
Synonyms: N-[2-(2,4-dichlorophenoxy)acetyl]morpholine-4-carboxamide
Smiles: O=C(NC(=O)N1CCOCC1)COc1ccc(cc1Cl)Cl

STK780647
Synonyms: 3,6-dichloro-N-[(2-chlorophenyl)carbamothioyl]-2-methoxybenzamide
Smiles: COc1c(Cl)ccc(c1C(=O)NC(=S)Nc1ccccc1Cl)Cl

STK780649
Synonyms: 6-[(2-chloro-6-methylpyrimidin-4-yl)sulfanyl]-N,N'-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
Smiles: CC(Nc1nc(Sc2cc(C)nc(n2)Cl)nc(n1)NC(C)C)C

STK780650
Synonyms: 6-[(2-chloro-6-methylpyrimidin-4-yl)sulfanyl]-N,N,N',N'-tetramethyl-1,3,5-triazine-2,4-diamine
Smiles: Cc1cc(Sc2nc(nc(n2)N(C)C)N(C)C)nc(n1)Cl

STK780651
Synonyms: 4-[(2-chloro-6-methylpyrimidin-4-yl)sulfanyl]-N-ethyl-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
Smiles: CCNc1nc(nc(n1)N1CCOCC1)Sc1cc(C)nc(n1)Cl

STK780652
Synonyms: 4-[(2-chloro-6-methylpyrimidin-4-yl)sulfanyl]-N,N-dimethyl-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
Smiles: Cc1cc(Sc2nc(nc(n2)N(C)C)N2CCOCC2)nc(n1)Cl

STK780653
Synonyms: N-tert-butyl-4-[(2-chloro-6-methylpyrimidin-4-yl)sulfanyl]-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
Smiles: Cc1cc(Sc2nc(nc(n2)NC(C)(C)C)N2CCOCC2)nc(n1)Cl

STK780654
Synonyms: 2-[(2-chloro-6-methylpyrimidin-4-yl)sulfanyl]-4,6-di(morpholin-4-yl)-1,3,5-triazine
Smiles: Cc1cc(Sc2nc(nc(n2)N2CCOCC2)N2CCOCC2)nc(n1)Cl

STK780656
Synonyms: 6-{[4-(dimethylamino)-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-2-phenylpyridazin-3(2H)-one
Smiles: CN(c1nc(Oc2ccc(=O)n(n2)c2ccccc2)nc(n1)N1CCOCC1)C

STK780657
Synonyms: 2-methyl-6-{[4-(methylamino)-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}pyridazin-3(2H)-one
Smiles: CNc1nc(Oc2ccc(=O)n(n2)C)nc(n1)N1CCOCC1

STK780658
Synonyms: 6-{[4-(tert-butylamino)-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-2-methylpyridazin-3(2H)-one
Smiles: O=c1ccc(nn1C)Oc1nc(nc(n1)N1CCOCC1)NC(C)(C)C

STK780660
Synonyms: N-tert-butyl-4-[(6-ethoxypyridazin-3-yl)oxy]-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
Smiles: CCOc1ccc(nn1)Oc1nc(nc(n1)N1CCOCC1)NC(C)(C)C

STK780661
Synonyms: methyl[(6-{[4-(tert-butylamino)-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}pyridazin-3-yl)oxy]acetate
Smiles: COC(=O)COc1ccc(nn1)Oc1nc(nc(n1)N1CCOCC1)NC(C)(C)C

STK780662
Synonyms: N-tert-butyl-4-(morpholin-4-yl)-6-[(6-propoxypyridazin-3-yl)oxy]-1,3,5-triazin-2-amine
Smiles: CCCOc1ccc(nn1)Oc1nc(nc(n1)N1CCOCC1)NC(C)(C)C

STK780664
Synonyms: methyl{[6-({4-[(2-methylpropyl)amino]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}oxy)pyridazin-3-yl]oxy}acetate
Smiles: COC(=O)COc1ccc(nn1)Oc1nc(NCC(C)C)nc(n1)N1CCOCC1

STK780665
Synonyms: 6-{[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]oxy}-2-methylpyridazin-3(2H)-one
Smiles: Cn1nc(ccc1=O)Oc1nc(nc(n1)N1CCOCC1)N1CCOCC1

STK780666
Synonyms: 4-[3-(butylsulfanyl)-1H-diaziren-1-yl]-5-ethyl-6-methylpyrimidin-2-amine
Smiles: CCCCSC1=NN1c1nc(N)nc(c1CC)C

STK780667
Synonyms: 4-(2-bromo-4-methylphenyl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Smiles: Cc1ccc(c(c1)Br)n1c(S)nnc1Cn1c(nc2c1cccc2)c1ccccn1

STK780668
Synonyms: ethyl(3-amino-5-methyl-1H-pyrazol-1-yl)acetate
Smiles: Cc1cc(nn1CC(=O)OCC)N

STK780669
Synonyms: 2,4-dichloro-5-(cyclopropylsulfamoyl)-N-(1-phenylethyl)benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)NC(c1ccccc1)C

STK780672
Synonyms: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-fluorophenoxy)acetamide
Smiles: N#Cc1c(NC(=O)COc2ccccc2F)sc2c1CCC(C2)C(C)(C)C

STK780673
Synonyms: N-(furan-2-ylmethyl)-2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}acetamide
Smiles: O=C(NCc1ccco1)COc1nsnc1N1CCOCC1

STK780675
Synonyms: 2-methylbenzyl4-(1H-pyrazol-1-yl)benzoate
Smiles: O=C(c1ccc(cc1)n1cccn1)OCc1ccccc1C

STK780676
Synonyms: 4-(piperidin-1-yl)-6-({5-[3-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}methyl)-1,3,5-triazin-2-amine
Smiles: Nc1nc(Cn2nnc(n2)c2cccc(c2)C(F)(F)F)nc(n1)N1CCCCC1

STK780677
Synonyms: 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-4-nitro-1H-pyrazole-3-carboxamide
Smiles: O=C(Cn1nc(c(c1)[N+](=O)[O-])C(=O)N)Nc1ccc2c(c1)OCO2

STK780678
Synonyms: N-(3-bromo-4-methylphenyl)-2-({4-methyl-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Br)C)CSc1nnc(n1C)Cn1c(C)ncc1[N+](=O)[O-]

STK780679
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-methyl-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: COc1cc(CCNC(=O)CSc2nnc(n2C)Cn2c(C)ncc2[N+](=O)[O-])ccc1OC

STK780680
Synonyms: 5-{[({4-methyl-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Smiles: O=C(Nc1nn(nc1C(=O)N)c1ccccc1)CSc1nnc(n1C)Cn1c(C)ncc1[N+](=O)[O-]

STK780681
Synonyms: N-(4-methoxybenzyl)-2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}acetamide
Smiles: COc1ccc(cc1)CNC(=O)COc1nsnc1N1CCOCC1

STK780682
Synonyms: (6-bromo-1,3-benzodioxol-5-yl)methyl1,2-dimethyl-4-nitro-1H-imidazole-5-carboxylate
Smiles: Brc1cc2OCOc2cc1COC(=O)c1c(nc(n1C)C)[N+](=O)[O-]

STK780683
Synonyms: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[5-(2-chlorophenyl)-2H-tetrazol-2-yl]acetamide
Smiles: N#Cc1c(NC(=O)Cn2nnc(n2)c2ccccc2Cl)sc2c1CCC(C2)C(C)(C)C

STK780685
Synonyms: N-[4-(morpholin-4-ylcarbonyl)phenyl]-2-{[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N2CCOCC2)nnc1c1cccnc1

STK780687
Synonyms: 3-{[(6-bromo-1,3-benzodioxol-5-yl)methyl]sulfanyl}-4-methyl-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazole
Smiles: Cn1c(nnc1Cn1c(C)ncc1[N+](=O)[O-])SCc1cc2OCOc2cc1Br

STK780688
Synonyms: N-[4-(morpholin-4-ylcarbonyl)phenyl]-2-[5-(thiophen-2-yl)-2H-tetrazol-2-yl]acetamide
Smiles: O=C(Cn1nnc(n1)c1cccs1)Nc1ccc(cc1)C(=O)N1CCOCC1

STK780689
Synonyms: ethyl({4-methyl-5-[(9-oxoacridin-10(9H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Smiles: CCOC(=O)CSc1nnc(n1C)Cn1c2ccccc2c(=O)c2c1cccc2

STK780690
Synonyms: 2-[4-(4-nitrophenyl)-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCCC2)N1C(=O)CC(C2=C1CCCC2=O)c1ccc(cc1)[N+](=O)[O-]

STK780691
Synonyms: 2-[4-(2-ethoxyphenyl)-7,7-dimethyl-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Smiles: CCOc1ccccc1C1CC(=O)N(C2=C1C(=O)CC(C2)(C)C)c1sc2c(c1C#N)CCCCC2

STK780692
Synonyms: 1-(3-fluorophenyl)-4-[4-(trifluoromethyl)phenyl]-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: Fc1cccc(c1)N1C(=O)CC(C2=C1COC2=O)c1ccc(cc1)C(F)(F)F

STK780694
Synonyms: 3-(4-chlorophenyl)-4-(2-ethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: CCOc1ccccc1C1CC(=O)Nc2c1c(n[nH]2)c1ccc(cc1)Cl

STK780695
Synonyms: ethyl3-({[5-(4-chlorophenyl)-2H-tetrazol-2-yl]acetyl}amino)-3-(3-nitrophenyl)propanoate
Smiles: CCOC(=O)CC(c1cccc(c1)[N+](=O)[O-])NC(=O)Cn1nnc(n1)c1ccc(cc1)Cl

STK780696
Synonyms: 2-amino-4-(4-fluorophenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(cc1)F)c(=O)nc1n2ccs1

STK780699
Synonyms: 1-[4-(cyclopentyloxy)phenyl]-6-methoxy-2,3,4,9-tetrahydro-1H-beta-carboline
Smiles: COc1ccc2c(c1)c1CCNC(c1[nH]2)c1ccc(cc1)OC1CCCC1

STK780700
Synonyms: 2-[4-(3-methylthiophen-2-yl)-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCCC2)N1C(=O)CC(C2=C1CCCC2=O)c1sccc1C

STK780701
Synonyms: 6-acetyl-3-amino-N-(2-methoxyphenyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydrothieno[2,3-b][1,6]naphthyridine-2-carboxamide
Smiles: COc1ccccc1NC(=O)c1sc2c(c1N)c(c1c(n2)CCN(C1)C(=O)C)C(F)(F)F

STK780702
Synonyms: ethyl(1,8,8-trimethyl-2,4-dioxo-3-azabicyclo[3.2.1]oct-3-yl)acetate
Smiles: CCOC(=O)CN1C(=O)C2CCC(C1=O)(C2(C)C)C

STK780703
Synonyms: 1-[2-chloro-5-(trifluoromethyl)phenyl]-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cscc1)C(=O)CCC2)c1cc(ccc1Cl)C(F)(F)F

STK780704
Synonyms: 5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-3-yl)-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccsc1)C(=O)CCC2)c1ccccc1C(F)(F)F

STK780706
Synonyms: 2-[4-(3,4-dimethoxyphenyl)-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Smiles: COc1cc(ccc1OC)C1CC(=O)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)CCCCC2

STK780707
Synonyms: 2-[4-(4-fluorophenyl)-7,7-dimethyl-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCCC2)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1)F

STK780708
Synonyms: 4-(2,5-dimethoxyphenyl)-1-(3-fluorophenyl)-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1ccc(c(c1)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)F)OC

STK780709
Synonyms: 3,5-dimethyl-4-(6-methyl-2,5-dioxo-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]quinolin-4-yl)-1H-pyrrole-2-carbonitrile
Smiles: N#Cc1[nH]c(c(c1C)C1CC(=O)Oc2c1c(=O)n(c1c2cccc1)C)C

STK780711
Synonyms: 4-(3-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(c2ccc(cc2)C(F)(F)F)C2=C(C1c1sccc1C)C(=O)CCC2

STK780712
Synonyms: 4-(3-fluorophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccc(c1)F)C(=O)CC(C2)(C)C)c1cccc(c1)C(F)(F)F

STK780713
Synonyms: 7,7-dimethyl-5-oxo-4-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccnc1)C(=O)CC(C2)(C)C)c1cccc(c1)C(F)(F)F

STK780714
Synonyms: 7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-3-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cscc1)C(=O)CC(C2)(C)C)c1cccc(c1)C(F)(F)F

STK780715
Synonyms: 1-[2-chloro-5-(trifluoromethyl)phenyl]-5-oxo-4-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccnc1)C(=O)CCC2)c1cc(ccc1Cl)C(F)(F)F

STK780716
Synonyms: 1-[2-chloro-5-(trifluoromethyl)phenyl]-4-(5-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc(s1)C)C(=O)CCC2)c1cc(ccc1Cl)C(F)(F)F

STK780717
Synonyms: 1-(4-bromo-2-methylphenyl)-5-oxo-4-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccnc1)C(=O)CCC2)c1ccc(cc1C)Br

STK780718
Synonyms: 1-(4-bromo-2-methylphenyl)-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cscc1)C(=O)CCC2)c1ccc(cc1C)Br

STK780720
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(3-chloro-4-methylphenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1ccc(c(c1)Cl)C

STK780721
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(3-chloro-2-methylphenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C)c1cccc(c1C)Cl

STK780722
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(3,5-dichlorophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1cc(Cl)cc(c1)Cl

STK780723
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1ccc(cc1)Br

STK780724
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1ccc(cc1)F

STK780725
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C)c1ccc(cc1)F

STK780726
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C)c1ccccc1F

STK780727
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(2,4-difluorophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1ccc(cc1F)F

STK780728
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(2,4-difluorophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C)c1ccc(cc1F)F

STK780729
Synonyms: 4-(1,3-benzodioxol-5-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1cccc(c1)C(F)(F)F

STK780730
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(2,6-difluorophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C)c1c(F)cccc1F

STK780731
Synonyms: 4-(1,3-benzodioxol-5-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1ccccc1C(F)(F)F

STK780732
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(2-chloro-4-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1ccc(cc1Cl)[N+](=O)[O-]

STK780733
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(4-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1ccc(cc1)[N+](=O)[O-]

STK780734
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(3-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1cccc(c1)[N+](=O)[O-]

STK780735
Synonyms: 4-(1,3-benzodioxol-5-yl)-5-oxo-1-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1cccnc1

STK780737
Synonyms: 2-[2,5-dioxo-4-(2,3,4-trimethoxyphenyl)-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: COc1c(OC)ccc(c1OC)C1CC(=O)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)CCCC2

STK780744
Synonyms: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-(4-nitro-1H-pyrazol-1-yl)butan-1-one
Smiles: O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CCCn1ncc(c1)[N+](=O)[O-]

STK780745
Synonyms: 2-(4-nitro-1H-pyrazol-1-yl)-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]propanamide
Smiles: O=C(C(n1ncc(c1)[N+](=O)[O-])C)Nc1nnc(s1)CCc1ccccc1

STK780747
Synonyms: 2-(4-nitro-1H-pyrazol-1-yl)-1-(piperidin-1-yl)propan-1-one
Smiles: CC(n1ncc(c1)[N+](=O)[O-])C(=O)N1CCCCC1

STK780748
Synonyms: 4-(4-nitro-1H-pyrazol-1-yl)-N-(propan-2-yl)butanamide
Smiles: CC(NC(=O)CCCn1ncc(c1)[N+](=O)[O-])C

STK780751
Synonyms: 4-[5-(2-chloro-4,5-difluorophenyl)-1,2,4-oxadiazol-3-yl]-2-methylquinoline
Smiles: Cc1nc2ccccc2c(c1)c1noc(n1)c1cc(F)c(cc1Cl)F

STK780752
Synonyms: 4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(pyridin-2-yl)butanamide
Smiles: O=C(Nc1ccccn1)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK780753
Synonyms: N-(2,5-dimethoxyphenyl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Smiles: COc1ccc(cc1NC(=O)CCCn1nc(c(c1C)[N+](=O)[O-])C)OC

STK780754
Synonyms: 4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(1,3-thiazol-2-yl)butanamide
Smiles: O=C(Nc1nccs1)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK780755
Synonyms: 4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(2-methoxydibenzo[b,d]furan-3-yl)butanamide
Smiles: COc1cc2c(cc1NC(=O)CCCn1nc(c(c1C)[N+](=O)[O-])C)oc1c2cccc1

STK780758
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NCc1ccc2c(c1)OCO2

STK780759
Synonyms: 3-(3,4-dimethoxyphenyl)-N-(3-fluorobenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NCc1cccc(c1)F

STK780760
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(4-nitro-1H-pyrazol-1-yl)propanamide
Smiles: O=C(C(n1ncc(c1)[N+](=O)[O-])C)NCCc1nc2c([nH]1)cccc2

STK780761
Synonyms: 2-(4-fluorophenoxy)-N-[1-(3-methylbenzyl)-1H-pyrazol-3-yl]acetamide
Smiles: O=C(Nc1ccn(n1)Cc1cccc(c1)C)COc1ccc(cc1)F

STK780762
Synonyms: N-[3-methyl-1-(3-methylbenzyl)-1H-pyrazol-5-yl]-4-(3-nitro-1H-pyrazol-1-yl)butanamide
Smiles: O=C(Nc1cc(nn1Cc1cccc(c1)C)C)CCCn1ccc(n1)[N+](=O)[O-]

STK780763
Synonyms: N-[3-methyl-1-(3-methylbenzyl)-1H-pyrazol-5-yl]furan-2-carboxamide
Smiles: Cc1cccc(c1)Cn1nc(cc1NC(=O)c1ccco1)C

STK780764
Synonyms: N-[1-(4-fluorobenzyl)-3-methyl-1H-pyrazol-5-yl]-4-(3-nitro-1H-pyrazol-1-yl)butanamide
Smiles: O=C(Nc1cc(nn1Cc1ccc(cc1)F)C)CCCn1ccc(n1)[N+](=O)[O-]

STK780765
Synonyms: N-(furan-2-ylmethyl)-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCc1ccco1

STK780766
Synonyms: N-(2,1,3-benzoxadiazol-4-yl)-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1non2)Cn1nc(c(c1C)Br)[N+](=O)[O-]

STK780767
Synonyms: N-(2,1,3-benzoxadiazol-4-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1non2)Cn1nc(cc1C)[N+](=O)[O-]

STK780768
Synonyms: N-(2,1,3-benzoxadiazol-4-yl)-2-(5-fluoro-2-nitrophenoxy)acetamide
Smiles: O=C(Nc1cccc2c1non2)COc1cc(F)ccc1[N+](=O)[O-]

STK780772
Synonyms: N-(2,1,3-benzoxadiazol-4-yl)-3-methoxybenzamide
Smiles: COc1cccc(c1)C(=O)Nc1cccc2c1non2

STK780773
Synonyms: N-(2,1,3-benzoxadiazol-4-yl)-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1cccc2c1non2

STK780774
Synonyms: N-(2,1,3-benzoxadiazol-4-yl)-3,5-dimethoxybenzamide
Smiles: COc1cc(OC)cc(c1)C(=O)Nc1cccc2c1non2

STK780778
Synonyms: 5-(4-chlorophenyl)-7-(4-ethylphenyl)-6-(pyridin-3-yl)-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
Smiles: CCc1ccc(cc1)N1C(=O)C2=C(C1c1cccnc1)C(=NCCN2)c1ccc(cc1)Cl

STK780780
Synonyms: 5-oxo-N-(propan-2-yl)-1-thioxo-4,5-dihydro[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Smiles: CC(NC(=O)c1sc(=S)n2c1[nH]c(=O)c1c2cccc1)C

STK780782
Synonyms: 2-(8,9-dimethoxy-5-oxo-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-6(5H)-yl)-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: COc1cc2c(cc1OC)c1c(n2CC(=O)Nc2ccccc2C(F)(F)F)c(=O)n2c(n1)SCC2

STK780784
Synonyms: 9-methyl-2,3-dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one
Smiles: Cc1ccc2c(c1)c1nc3SCCn3c(=O)c1[nH]2

STK780788
Synonyms: N-[4-(2H-benzotriazol-2-yl)phenyl]-4-fluoro-N-(propan-2-yl)benzamide
Smiles: CC(N(C(=O)c1ccc(cc1)F)c1ccc(cc1)n1nc2c(n1)cccc2)C

STK780789
Synonyms: N-[4-(2H-benzotriazol-2-yl)phenyl]-3-nitro-N-(propan-2-yl)benzamide
Smiles: CC(N(C(=O)c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)n1nc2c(n1)cccc2)C

STK780790
Synonyms: 4-(4-nitro-1H-pyrazol-1-yl)-N-(1-phenylethyl)butanamide
Smiles: O=C(NC(c1ccccc1)C)CCCn1ncc(c1)[N+](=O)[O-]

STK780792
Synonyms: N-(4,6-dimethylpyrimidin-2-yl)-2-(4-nitro-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1ncc(c1)[N+](=O)[O-])Nc1nc(C)cc(n1)C

STK780794
Synonyms: methyl2-{[4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanoyl]amino}benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK780795
Synonyms: N-[4-(cyanomethyl)phenyl]-2-(3-nitro-1H-pyrazol-1-yl)acetamide
Smiles: N#CCc1ccc(cc1)NC(=O)Cn1ccc(n1)[N+](=O)[O-]

STK780796
Synonyms: 1-(azepan-1-yl)-2-(3-nitro-1H-pyrazol-1-yl)ethanone
Smiles: O=C(N1CCCCCC1)Cn1ccc(n1)[N+](=O)[O-]

STK780797
Synonyms: 2-(3-nitro-1H-pyrazol-1-yl)-1-(piperidin-1-yl)ethanone
Smiles: O=C(N1CCCCC1)Cn1ccc(n1)[N+](=O)[O-]

STK780798
Synonyms: 1-(3,4-dihydroquinolin-1(2H)-yl)-2-(3-nitro-1H-pyrazol-1-yl)ethanone
Smiles: O=C(N1CCCc2c1cccc2)Cn1ccc(n1)[N+](=O)[O-]

STK780799
Synonyms: 1-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butan-1-one
Smiles: O=C(n1nc(c(c1C)Cl)C)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK780800
Synonyms: N-(3,4-dimethoxybenzyl)-2-(3-nitro-1H-pyrazol-1-yl)acetamide
Smiles: COc1cc(CNC(=O)Cn2ccc(n2)[N+](=O)[O-])ccc1OC

STK780801
Synonyms: N-(3,4-dimethoxybenzyl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: COc1cc(CNC(=O)Cn2nc(c(c2C)I)C)ccc1OC

STK780802
Synonyms: N-(3,4-dimethoxybenzyl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Smiles: COc1cc(CNC(=O)Cn2nc(cc2C)[N+](=O)[O-])ccc1OC

STK780803
Synonyms: 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(3,4-dimethoxybenzyl)acetamide
Smiles: COc1cc(CNC(=O)Cn2nc(c(c2C)Br)[N+](=O)[O-])ccc1OC

STK780804
Synonyms: N-(3,4-dimethoxybenzyl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Smiles: COc1cc(CNC(=O)CCCn2nc(c(c2C)[N+](=O)[O-])C)ccc1OC

STK780805
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(3-nitro-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1ccc(n1)[N+](=O)[O-])NCCc1nc2c([nH]1)cccc2

STK780807
Synonyms: N-(furan-2-ylmethyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NCc1ccco1

STK780810
Synonyms: 3-(1,3-benzodioxol-5-yl)-N-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)OCO2)NCCC12CC3CC(C2)CC(C1)C3

STK780812
Synonyms: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(c(c1C)Br)C)NCCC12CC3CC(C2)CC(C1)C3

STK780813
Synonyms: 4-(4-nitro-1H-pyrazol-1-yl)-N-(5-nitro-1,3-thiazol-2-yl)butanamide
Smiles: O=C(Nc1ncc(s1)[N+](=O)[O-])CCCn1ncc(c1)[N+](=O)[O-]

STK780814
Synonyms: N-[2-(1H-indol-3-yl)ethyl]-2-(4-nitro-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1ncc(c1)[N+](=O)[O-])NCCc1c[nH]c2c1cccc2

STK780815
Synonyms: N-[2-(1H-indol-3-yl)ethyl]-4-(4-nitro-1H-pyrazol-1-yl)butanamide
Smiles: O=C(NCCc1c[nH]c2c1cccc2)CCCn1ncc(c1)[N+](=O)[O-]

STK780816
Synonyms: N-(5-chloropyridin-2-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])Nc1ccc(cn1)Cl

STK780817
Synonyms: 2-(5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])Nc1nccs1

STK780818
Synonyms: 2-(5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(5-nitro-1,3-thiazol-2-yl)acetamide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])Nc1ncc(s1)[N+](=O)[O-]

STK780819
Synonyms: 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(2-methoxydibenzo[b,d]furan-3-yl)acetamide
Smiles: COc1cc2c(cc1NC(=O)Cn1nc(c(c1C)Br)[N+](=O)[O-])oc1c2cccc1

STK780821
Synonyms: 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[2-(1H-indol-3-yl)ethyl]acetamide
Smiles: O=C(Cn1nc(c(c1C)Br)[N+](=O)[O-])NCCc1c[nH]c2c1cccc2

STK780822
Synonyms: 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(1H-pyrazol-1-yl)ethanone
Smiles: [O-][N+](=O)c1nn(c(c1Br)C)CC(=O)n1cccn1

STK780824
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-(3-nitro-1H-pyrazol-1-yl)acetamide
Smiles: N#Cc1c(NC(=O)Cn2ccc(n2)[N+](=O)[O-])sc2c1CCC2

STK780826
Synonyms: N-(4-fluorobenzyl)-N-[3-(furan-2-yl)-3-phenylpropyl]furan-2-carboxamide
Smiles: Fc1ccc(cc1)CN(C(=O)c1ccco1)CCC(c1ccco1)c1ccccc1

STK780827
Synonyms: N-(furan-2-ylmethyl)-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-thiopyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-8-amine
Smiles: CC1(C)SCc2c(C1)c1c(nc2N2CCOCC2)sc2c1nnnc2NCc1ccco1

STK780828
Synonyms: N-[2,4,6-trioxo-1-(2-phenylethyl)-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]pyridine-3-carboxamide
Smiles: O=C(c1cccnc1)NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2CCc1ccccc1)C(F)(F)F

STK780830
Synonyms: 7-(4-fluorophenyl)-1-(furan-2-ylmethyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Smiles: Fc1ccc(cc1)C1=NC(c2c(N1)n(Cc1ccco1)c(=O)[nH]c2=O)(C(F)(F)F)C(F)(F)F

STK780832
Synonyms: N-[6,6-dimethyl-2,4-dioxo-1-(tetrahydrofuran-2-ylmethyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-2-fluorobenzamide
Smiles: O=C1CC(C)(C)CC2=C1C(NC(=O)c1ccccc1F)(C(=O)N2CC1CCCO1)C(F)(F)F

STK780833
Synonyms: N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl]-3,4,5-trimethoxybenzamide
Smiles: N#CC1=C(C)NC(=O)C1(NC(=O)c1cc(OC)c(c(c1)OC)OC)C(F)(F)F

STK780834
Synonyms: N-[1-(2-fluorophenyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC1(NC(=O)N(C1=O)c1ccccc1F)C(F)(F)F

STK780835
Synonyms: N-[1-(furan-2-ylmethyl)-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-3,4-dimethoxybenzamide
Smiles: COc1ccc(cc1OC)C(=O)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)Cc1ccco1)C(F)(F)F

STK780836
Synonyms: 2-methyl-5-oxo-4-(1,3-thiazol-2-ylamino)-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carbonitrile
Smiles: N#CC1=C(C)NC(=O)C1(Nc1nccs1)C(F)(F)F

STK780837
Synonyms: 5-[(4-methylpyridin-2-yl)amino]-2-phenyl-5-(trifluoromethyl)-3,5-dihydro-4H-imidazol-4-one
Smiles: Cc1ccnc(c1)NC1(N=C(NC1=O)c1ccccc1)C(F)(F)F

STK780838
Synonyms: 4-[(5-chloropyridin-2-yl)amino]-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carbonitrile
Smiles: N#CC1=C(C)NC(=O)C1(Nc1ccc(cn1)Cl)C(F)(F)F

STK780839
Synonyms: 3-(1,3-benzothiazol-2-ylamino)-6,6-dimethyl-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-3,5,6,7-tetrahydro-1H-indole-2,4-dione
Smiles: O=C1CC(C)(C)CC2=C1C(Nc1nc3c(s1)cccc3)(C(=O)N2Cc1cccnc1)C(F)(F)F

STK780840
Synonyms: ethyl2-methyl-5-oxo-4-[(pyridin-3-ylcarbonyl)amino]-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)C1(NC(=O)c1cccnc1)C(F)(F)F

STK780841
Synonyms: 7,7-dimethyl-1-(2-phenylethyl)-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazoline-2,5(1H,3H)-dione
Smiles: O=C1NC(C2=C(N1CCc1ccccc1)CC(CC2=O)(C)C)(C(F)(F)F)C(F)(F)F

STK780842
Synonyms: methyl4-{[(3,4-dimethoxyphenyl)carbonyl]amino}-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: COC(=O)C1=C(C)NC(=O)C1(NC(=O)c1ccc(c(c1)OC)OC)C(F)(F)F

STK780845
Synonyms: 4-bromo-N-(2,6-dibromo-4-fluorophenyl)-1-ethyl-1H-pyrazole-5-carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1c(Br)cc(cc1Br)F)Br

STK780847
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,5-dimethyl-1H-pyrazole-4-sulfonamide
Smiles: Cn1ncc(c1C)S(=O)(=O)Nc1ccc2c(c1)OCCO2

STK780848
Synonyms: 4-chloro-N-(2-ethoxyphenyl)-1-ethyl-1H-pyrazole-3-carboxamide
Smiles: CCOc1ccccc1NC(=O)c1nn(cc1Cl)CC

STK780850
Synonyms: dimethyl5-{[(4-chloro-1-ethyl-1H-pyrazol-3-yl)carbonyl]amino}benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(cc(c1)C(=O)OC)NC(=O)c1nn(cc1Cl)CC

STK780851
Synonyms: 4-chloro-1-ethyl-N-[2-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxamide
Smiles: CCn1cc(c(n1)C(=O)Nc1ccccc1C(F)(F)F)Cl

STK780852
Synonyms: 4-chloro-N-(3,4-dimethoxyphenyl)-1-ethyl-1H-pyrazole-3-carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)c1nn(cc1Cl)CC

STK780854
Synonyms: 4-chloro-N-(2,4-difluorophenyl)-1-ethyl-1H-pyrazole-3-carboxamide
Smiles: CCn1cc(c(n1)C(=O)Nc1ccc(cc1F)F)Cl

STK780856
Synonyms: 4-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-1H-pyrazole-3-carboxamide
Smiles: CCn1cc(c(n1)C(=O)Nc1ccc2c(c1)OCCO2)Cl

STK780857
Synonyms: 4-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethyl-1H-pyrazole-3-carboxamide
Smiles: COc1cc(CCNC(=O)c2nn(cc2Cl)CC)ccc1OC

STK780858
Synonyms: 4-chloro-1-ethyl-N-[4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxamide
Smiles: CCn1nc(c(c1)Cl)C(=O)Nc1ccc(cc1)C(F)(F)F

STK780862
Synonyms: N-(9,10-dioxo-9,10-dihydroanthracen-1-yl)-2-(piperidin-1-yl)acetamide
Smiles: O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)CN1CCCCC1

STK780863
Synonyms: 3-bromo-5-[(2-hydroxyethyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: OCCNc1cc(Br)c2c3c1C(=O)c1ccccc1c3on2

STK780864
Synonyms: 3-bromo-5-(morpholin-4-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: O=C1c2ccccc2c2c3c1c(cc(c3no2)Br)N1CCOCC1

STK780866
Synonyms: 6-(2-ethoxyphenyl)-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: CCOc1ccccc1n1cc2c(c1c1ccccc1)c(=O)n(c(=O)n2C)C

STK780867
Synonyms: 4-bromo-2-fluoro-N-[2-(trifluoromethyl)-1H-benzimidazol-4-yl]benzamide
Smiles: Brc1ccc(c(c1)F)C(=O)Nc1cccc2c1nc([nH]2)C(F)(F)F

STK780868
Synonyms: 1-[2-(4-fluorophenyl)-2-methyl-5-(3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethanone
Smiles: Fc1ccc(cc1)C1(C)OC(=NN1C(=O)C)c1cccc(c1)[N+](=O)[O-]

STK780869
Synonyms: 4-tert-butylcyclohexyl5-({4-[chloro(difluoro)methoxy]phenyl}amino)-5-oxopentanoate
Smiles: O=C(Nc1ccc(cc1)OC(Cl)(F)F)CCCC(=O)OC1CCC(CC1)C(C)(C)C

STK780871
Synonyms: 6-methoxy-1-{3-methoxy-4-[(4-nitrobenzyl)oxy]phenyl}-2,3,4,9-tetrahydro-1H-beta-carboline
Smiles: COc1ccc2c(c1)c1CCNC(c1[nH]2)c1ccc(c(c1)OC)OCc1ccc(cc1)[N+](=O)[O-]

STK780873
Synonyms: ethyl6-methyl-4-(3-nitrophenyl)-2-oxo-3-(phenylacetyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)N(C1c1cccc(c1)[N+](=O)[O-])C(=O)Cc1ccccc1

STK780874
Synonyms: 3-[(2-hydroxyethyl)amino]-5-(morpholin-4-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: OCCNc1cc(N2CCOCC2)c2c3c1noc3c1c(C2=O)cccc1

STK780875
Synonyms: 3-[(2-hydroxyethyl)amino]-5-[(3-methylphenyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: OCCNc1cc(Nc2cccc(c2)C)c2c3c1noc3c1c(C2=O)cccc1

STK780880
Synonyms: {4-[3-(4-bromo-1,3-dimethyl-1H-pyrazol-5-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]phenyl}aceticacid
Smiles: OC(=O)Cc1ccc(cc1)n1c(S)nnc1c1n(C)nc(c1Br)C

STK780881
Synonyms: 2-[(2,4-dimethyl-6-nitrophenyl)amino]-4H-pyrido[3,2-e][1,3]thiazin-4-one
Smiles: Cc1cc(C)c(c(c1)[N+](=O)[O-])Nc1nc(=O)c2c(s1)nccc2

STK780882
Synonyms: 4,5-bis(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-oxazol-2(3H)-one
Smiles: COc1ccc(cc1)c1c(oc(=O)n1CC(=O)c1ccc(cc1)OC)c1ccc(cc1)OC

STK780883
Synonyms: 2-[2,5-dioxo-4-(thiophen-2-yl)-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCCC2)N1C(=O)CC(C2=C1CCCC2=O)c1cccs1

STK780884
Synonyms: 2-[4-(4-ethylphenyl)-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Smiles: CCc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)CCCCC2

STK780885
Synonyms: 2-[7,7-dimethyl-4-(3-nitrophenyl)-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCCC2)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cccc(c1)[N+](=O)[O-]

STK780886
Synonyms: 2-[7,7-dimethyl-4-(3-methylphenyl)-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCCC2)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cccc(c1)C

STK780887
Synonyms: 4,7-diamino-2-[(2-chlorobenzyl)sulfanyl]-5-(2,3-dimethoxyphenyl)-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1OC)OC)c(N)nc(n2)SCc1ccccc1Cl

STK780888
Synonyms: ethyl4-(3-methoxyphenyl)-2,5-dioxo-7-phenyl-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1cccc(c1)OC)c1ccccc1

STK780889
Synonyms: ethyl4-(4-ethylphenyl)-7-(furan-2-yl)-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Smiles: CCOC(=O)C1C(=O)C2=C(CC1c1ccco1)NC(=O)CC2c1ccc(cc1)CC

STK780891
Synonyms: ethyl4-(3-chlorophenyl)-7-(furan-2-yl)-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1cccc(c1)Cl)c1ccco1

STK780897
Synonyms: 4-(4-fluorophenyl)-3-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1CC(c2ccc(cc2)F)c2c(N1)[nH]nc2c1ccccc1

STK780898
Synonyms: 3-(4-chlorophenyl)-4-(4-fluorophenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1Nc2[nH]nc(c2C(C1)c1ccc(cc1)F)c1ccc(cc1)Cl

STK780899
Synonyms: 4-(2,5-dimethoxyphenyl)-3-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: COc1ccc(c(c1)C1CC(=O)Nc2c1c(n[nH]2)c1ccccc1)OC

STK780900
Synonyms: 4-(3,4-dimethoxyphenyl)-3-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: COc1cc(ccc1OC)C1CC(=O)Nc2c1c(n[nH]2)c1ccccc1

STK780901
Synonyms: 3-phenyl-4-(3,4,5-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)Nc2c1c(n[nH]2)c1ccccc1

STK780903
Synonyms: 4-(1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1Nc2[nH]nc(c2C(C1)c1ccc2c(c1)OCO2)c1ccc(cc1)Cl

STK780904
Synonyms: 2-amino-4-(3-methoxyphenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cccc(c1)OC)c(=O)nc1n2ccs1

STK780905
Synonyms: 2-amino-4-(3-chlorophenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cccc(c1)Cl)c(=O)nc1n2ccs1

STK780906
Synonyms: 2-amino-4-(2,5-dimethoxyphenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cc(OC)ccc1OC)c(=O)nc1n2ccs1

STK780907
Synonyms: 2-amino-4-[4-(methylsulfanyl)phenyl]-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(cc1)SC)c(=O)nc1n2ccs1

STK780908
Synonyms: 2-amino-4-(3-methylphenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cccc(c1)C)c(=O)nc1n2ccs1

STK780909
Synonyms: 2-amino-4-(4-bromothiophen-2-yl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1scc(c1)Br)c(=O)nc1n2ccs1

STK780910
Synonyms: 4-(5-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc(s1)C)C(=O)CCC2)c1ccc(cc1)C(F)(F)F

STK780911
Synonyms: 4-(3-chlorophenyl)-3,4-dihydro-2H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-2,5(1H)-dione
Smiles: O=C1CC(c2cccc(c2)Cl)c2c(N1)n1ccsc1nc2=O

STK780912
Synonyms: N-(6-cyano-1,3-benzodioxol-5-yl)-2-(2-oxo-1,3-benzothiazol-3(2H)-yl)acetamide
Smiles: N#Cc1cc2OCOc2cc1NC(=O)Cn1c(=O)sc2c1cccc2

STK780913
Synonyms: methyl4-methoxy-3-{[(2-oxo-1,3-benzothiazol-3(2H)-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)Cn1c(=O)sc3c1cccc3)c(OC)ccc2

STK780917
Synonyms: 4-amino-2-[(3-fluorophenyl)amino]-5-(phenylcarbonyl)thiophene-3-carbonitrile
Smiles: N#Cc1c(Nc2cccc(c2)F)sc(c1N)C(=O)c1ccccc1

STK780918
Synonyms: 2-(4-fluorophenyl)-6-iodoimidazo[1,2-a]pyridine
Smiles: Fc1ccc(cc1)c1cn2c(n1)ccc(c2)I

STK780919
Synonyms: 7-chloro-2,3-diphenyl-10H-pyridazino[6,1-b]quinazolin-10-one
Smiles: Clc1ccc2c(c1)nc1n(c2=O)nc(c(c1)c1ccccc1)c1ccccc1

STK780921
Synonyms: 1-(3-chlorobenzyl)-4-(piperidin-1-yl)pyrimidin-2(1H)-one
Smiles: Clc1cccc(c1)Cn1ccc(nc1=O)N1CCCCC1

STK780922
Synonyms: N-[2-(2-methyl-1H-indol-3-yl)ethyl]-5-nitropyridin-2-amine
Smiles: [O-][N+](=O)c1ccc(nc1)NCCc1c(C)[nH]c2c1cccc2

STK780925
Synonyms: 1-ethyl-6-fluoro-7-(morpholin-4-yl)-3-nitroquinolin-4(1H)-one
Smiles: CCn1cc([N+](=O)[O-])c(=O)c2c1cc(N1CCOCC1)c(c2)F

STK780927
Synonyms: 4-tert-butylcyclohexyl5-{[1-(2-chlorophenyl)-3-ethoxy-3-oxopropyl]amino}-5-oxopentanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)CCCC(=O)OC1CCC(CC1)C(C)(C)C

STK780928
Synonyms: N-({4-[chloro(difluoro)methoxy]phenyl}carbamoyl)-3-methylbenzamide
Smiles: O=C(NC(=O)c1cccc(c1)C)Nc1ccc(cc1)OC(Cl)(F)F

STK780929
Synonyms: N-({4-[chloro(difluoro)methoxy]phenyl}carbamoyl)-3-methoxybenzamide
Smiles: COc1cccc(c1)C(=O)NC(=O)Nc1ccc(cc1)OC(Cl)(F)F

STK780930
Synonyms: 2-{[6-amino-4-oxo-1-(2-phenylethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}-N-(5-chloropyridin-2-yl)butanamide
Smiles: CCC(C(=O)Nc1ccc(cn1)Cl)Sc1nc(=O)cc(n1CCc1ccccc1)N

STK780932
Synonyms: 5-(methylsulfanyl)-3-(propan-2-yloxy)-1,2-thiazole-4-carbonitrile
Smiles: N#Cc1c(nsc1SC)OC(C)C

STK780933
Synonyms: 4-amino-5-[(4-chlorophenyl)carbonyl]-2-[(3-fluorophenyl)amino]thiophene-3-carbonitrile
Smiles: N#Cc1c(Nc2cccc(c2)F)sc(c1N)C(=O)c1ccc(cc1)Cl

STK780934
Synonyms: 2-amino-4-(3,4-difluorophenyl)-5-oxo-4H,5H-thiochromeno[4,3-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)F)F)c(=O)sc1c2cccc1

STK780936
Synonyms: methylN-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}-S-benzylcysteinate
Smiles: COC(=O)C(NC(=O)CSc1nnc(s1)N)CSCc1ccccc1

STK780937
Synonyms: methylN-[(1,3-benzoxazol-2-ylsulfanyl)acetyl]-S-benzylcysteinate
Smiles: COC(=O)C(NC(=O)CSc1nc2c(o1)cccc2)CSCc1ccccc1

STK780938
Synonyms: methylN-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-S-benzylcysteinate
Smiles: COC(=O)C(NC(=O)CSc1nc2c(s1)cccc2)CSCc1ccccc1

STK780939
Synonyms: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(1,5-diphenyl-1H-imidazol-2-yl)sulfanyl]acetamide
Smiles: O=C(Nc1cc2OCOc2cc1C(=O)C)CSc1ncc(n1c1ccccc1)c1ccccc1

STK780940
Synonyms: ethyl4-({[(4-benzyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nc(Cc2ccccc2)cc(=O)[nH]1

STK780941
Synonyms: 6-(but-3-yn-1-yloxy)-N,N,N',N'-tetramethyl-1,3,5-triazine-2,4-diamine
Smiles: CN(c1nc(OCCC#C)nc(n1)N(C)C)C

STK780942
Synonyms: 2-ethyl-5-(furan-2-yl)-6-phenyl-4,5-dihydro-1,2,4-triazin-3(2H)-one
Smiles: CCN1N=C(c2ccccc2)C(NC1=O)c1ccco1

STK780944
Synonyms: ethyl6,7-difluoro-4-[(2-hydroxyphenyl)amino]quinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccccc1O)cc(c(c2)F)F

STK780946
Synonyms: ethyl6,7-difluoro-4-(pyrrolidin-1-yl)quinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1N1CCCC1)cc(c(c2)F)F

STK780947
Synonyms: ethyl4-chloro-6,7-difluoroquinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Cl)cc(c(c2)F)F

STK780948
Synonyms: 3-amino-7-fluoro-6-(morpholin-4-yl)quinoxaline-2-carbonitrile
Smiles: N#Cc1nc2cc(F)c(cc2nc1N)N1CCOCC1

STK780949
Synonyms: N-[8-(benzyloxy)-3-nitrodibenzo[b,f]oxepin-1-yl]-N-methylacetamide
Smiles: CC(=O)N(c1cc(cc2c1C=Cc1c(O2)ccc(c1)OCc1ccccc1)[N+](=O)[O-])C

STK780950
Synonyms: ethyl4-({4-[1-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]phenyl}sulfamoyl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)c1cc(nn1c1ccccc1)C(F)(F)F

STK780954
Synonyms: 4-tert-butylcyclohexyl5-{[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]amino}-5-oxopentanoate
Smiles: O=C(NCCc1c(C)[nH]c2c1cc(F)cc2)CCCC(=O)OC1CCC(CC1)C(C)(C)C

STK780955
Synonyms: N-[4-(acetylamino)phenyl]-4-bromo-1-ethyl-1H-pyrazole-5-carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1ccc(cc1)NC(=O)C)Br

STK780956
Synonyms: 3-(3-chlorophenyl)-1-(4-ethoxyphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea
Smiles: CCOc1ccc(cc1)N(C(=O)Nc1cccc(c1)Cl)Cc1nnc2n1CCCCC2

STK780957
Synonyms: 1-(4-ethoxyphenyl)-3-(3-methylphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea
Smiles: CCOc1ccc(cc1)N(C(=O)Nc1cccc(c1)C)Cc1nnc2n1CCCCC2

STK780961
Synonyms: 6-[4-(difluoromethoxy)phenyl]-3-(4-methylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: FC(Oc1ccc(cc1)C1=Nn2c(SC1)nnc2c1ccc(cc1)C)F

STK780962
Synonyms: N-{[4-(4-chlorophenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulen-1-yl]methyl}aniline
Smiles: Clc1ccc(cc1)c1cn2c3c1CCCCn3c(n2)CNc1ccccc1

STK780965
Synonyms: N-[4-(acetylamino)phenyl]-4-chloro-1-ethyl-1H-pyrazole-3-carboxamide
Smiles: CCn1cc(c(n1)C(=O)Nc1ccc(cc1)NC(=O)C)Cl

STK780967
Synonyms: N-(2-ethoxyphenyl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Smiles: CCOc1ccccc1NC(=O)c1nn(cc1[N+](=O)[O-])CC

STK780968
Synonyms: N-(3-chloro-2-methylphenyl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Smiles: CCn1nc(c(c1)[N+](=O)[O-])C(=O)Nc1cccc(c1C)Cl

STK780969
Synonyms: N-(3,4-dimethoxyphenyl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)c1nn(cc1[N+](=O)[O-])CC

STK780970
Synonyms: 1-ethyl-N-(3-fluorophenyl)-4-nitro-1H-pyrazole-3-carboxamide
Smiles: CCn1nc(c(c1)[N+](=O)[O-])C(=O)Nc1cccc(c1)F

STK780971
Synonyms: 1-ethyl-4-nitro-N-[3-(1,2-oxazol-5-yl)phenyl]-1H-pyrazole-3-carboxamide
Smiles: CCn1nc(c(c1)[N+](=O)[O-])C(=O)Nc1cccc(c1)c1ccno1

STK780972
Synonyms: N-(2-carbamoylphenyl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Smiles: CCn1nc(c(c1)[N+](=O)[O-])C(=O)Nc1ccccc1C(=O)N

STK780973
Synonyms: N-benzyl-4-(4-methylphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: Cc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=S)NCc1ccccc1)c1ccccc1

STK780974
Synonyms: N-benzyl-1-(4-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: COc1ccc(cc1)c1c(C(=S)NCc2ccccc2)n2c3c1CCCCn3c(c2)c1ccc(cc1)C

STK780975
Synonyms: 4-(4-chlorophenyl)-1-(4-methoxyphenyl)-N-(prop-2-en-1-yl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: C=CCNC(=S)c1c(c2ccc(cc2)OC)c2c3n1cc(n3CCCC2)c1ccc(cc1)Cl

STK780976
Synonyms: 4-(4-bromophenyl)-1-(4-fluorophenyl)-N-(prop-2-en-1-yl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: C=CCNC(=S)c1c(c2ccc(cc2)F)c2c3n1cc(n3CCCC2)c1ccc(cc1)Br

STK780978
Synonyms: 2-(1H-benzimidazol-2-ylsulfanyl)-5-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide
Smiles: O=C(c1cc(ccc1Sc1nc2c([nH]1)cccc2)[N+](=O)[O-])NCC1CCCO1

STK780979
Synonyms: 1-{4-[(4-methylphenyl)sulfonyl]-3-nitrophenyl}ethanone
Smiles: Cc1ccc(cc1)S(=O)(=O)c1ccc(cc1[N+](=O)[O-])C(=O)C

STK780982
Synonyms: 7-chloro-2-(3,4-diethoxyphenyl)-3-hydroxy-4H-chromen-4-one
Smiles: CCOc1cc(ccc1OCC)c1oc2cc(Cl)ccc2c(=O)c1O

STK780983
Synonyms: 1'-(2-chlorobenzyl)-5-methyl-5-nitrospiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Smiles: Clc1ccccc1CN1c2ccccc2C2(C1=O)OCC(CO2)(C)[N+](=O)[O-]

STK780984
Synonyms: 1'-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-4,5,6,7,8,8a-hexahydro-3aH-spiro[cyclohepta[d][1,3]dioxole-2,3'-indol]-2'(1'H)-one
Smiles: O=C1N(CN2CCN(CC2)c2ccccc2F)c2c(C31OC1C(O3)CCCCC1)cccc2

STK780985
Synonyms: 1'-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-4,5,6,7,8,8a-hexahydro-3aH-spiro[cyclohepta[d][1,3]dioxole-2,3'-indol]-2'(1'H)-one
Smiles: O=C1N(CN2CCc3c(C2)cccc3)c2c(C31OC1C(O3)CCCCC1)cccc2

STK780987
Synonyms: 2-methoxyethyl1-(3-chlorophenyl)-5-hydroxy-2-methyl-1H-indole-3-carboxylate
Smiles: COCCOC(=O)c1c(C)n(c2c1cc(O)cc2)c1cccc(c1)Cl

STK780990
Synonyms: ethyl5-{[({[1,3-dimethyl-2,6-dioxo-7-(prop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetyl)amino]methyl}furan-2-carboxylate
Smiles: C=CCn1c(SCC(=O)NCc2ccc(o2)C(=O)OCC)nc2c1c(=O)n(c(=O)n2C)C

STK780991
Synonyms: ethyl5-[({[5-(2-fluorophenyl)-2H-tetrazol-2-yl]acetyl}amino)methyl]furan-2-carboxylate
Smiles: CCOC(=O)c1ccc(o1)CNC(=O)Cn1nnc(n1)c1ccccc1F

STK780992
Synonyms: 2,6-dichlorobenzyl4-(1H-pyrazol-1-yl)benzoate
Smiles: O=C(c1ccc(cc1)n1cccn1)OCc1c(Cl)cccc1Cl

STK780993
Synonyms: 3-methoxybenzyl4-[5-(3-methoxybenzyl)-1H-tetrazol-1-yl]benzoate
Smiles: COc1cccc(c1)COC(=O)c1ccc(cc1)n1nnnc1Cc1cccc(c1)OC

STK780994
Synonyms: 2,4-dichlorobenzyl4-(1H-pyrazol-1-yl)benzoate
Smiles: Clc1ccc(c(c1)Cl)COC(=O)c1ccc(cc1)n1cccn1

STK780996
Synonyms: methyl1-{2-[(3-acetylphenyl)amino]-2-oxoethyl}-1H-pyrazole-3-carboxylate
Smiles: COC(=O)c1ccn(n1)CC(=O)Nc1cccc(c1)C(=O)C

STK780998
Synonyms: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-methyl-5-nitro-1H-imidazol-1-yl)acetamide
Smiles: N#Cc1c(NC(=O)Cn2c(C)ncc2[N+](=O)[O-])sc2c1CCC(C2)C

STK780999
Synonyms: 2,7,7-trimethyl-4-[4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-N-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: CC1=C(C(=O)Nc2ccccc2)C(C2=C(N1)CC(C)(C)CC2=O)c1scc(c1)CN1CCOCC1

STK781005
Synonyms: (2Z)-2-[(1R,2R,5S)-2-{4-methyl-3-[(9-oxoacridin-10(9H)-yl)methyl]-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl}-6,8-dioxabicyclo[3.2.1]oct-4-ylidene]hydrazinecarbothioamide(non-preferredname)
Smiles: NC(=S)N/N=C\1/C[C@H]([C@H]2O[C@@H]1OC2)n1nc(n(c1=S)C)Cn1c2ccccc2c(=O)c2c1cccc2

STK781006
Synonyms: ethyl3-(4-methylphenyl)-3-({[5-(thiophen-2-yl)-2H-tetrazol-2-yl]acetyl}amino)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)Cn1nnc(n1)c1cccs1

STK781007
Synonyms: ethyl2-amino-7,7-dimethyl-4-(4-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}thiophen-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C1c1scc(c1)CSc1nnnn1C)C(=O)CC(C2)(C)C

STK781010
Synonyms: (2E)-2-({4-[(1,3-benzothiazol-2-ylsulfanyl)methyl]thiophen-2-yl}methylidene)hydrazinecarboxamide
Smiles: NC(=O)N/N=C/c1scc(c1)CSc1nc2c(s1)cccc2

STK781011
Synonyms: methyl4-{4-[(1,3-benzothiazol-2-ylsulfanyl)methyl]thiophen-2-yl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COC(=O)C1=C(C)NC2=C(C1c1scc(c1)CSc1nc3c(s1)cccc3)C(=O)CCC2

STK781012
Synonyms: 2-methyl-4-(4-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}thiophen-2-yl)-5-oxo-N-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: CC1=C(C(=O)Nc2ccccc2)C(C2=C(N1)CCCC2=O)c1scc(c1)CSc1nnnn1C

STK781014
Synonyms: 2-amino-4-(4-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}thiophen-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1scc(c1)CSc1nnc(s1)N)C(=O)CCC2

STK781015
Synonyms: 2-amino-4-(4-{[(1-methyl-1H-imidazol-2-yl)sulfanyl]methyl}thiophen-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1scc(c1)CSc1nccn1C)C(=O)CCC2

STK781016
Synonyms: 6-(butan-2-yl)-1-(3-methylphenyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCC(N1CNc2c(C1)c(=O)[nH]c(=S)n2c1cccc(c1)C)C

STK781017
Synonyms: 6-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-methylprop-2-en-1-yl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1cc(CCN2CNc3c(C2)c(=O)[nH]c(=S)n3CC(=C)C)ccc1OC

STK781018
Synonyms: {4-[3-(pyridin-4-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]phenyl}aceticacid
Smiles: OC(=O)Cc1ccc(cc1)n1c(S)nnc1c1ccncc1

STK781020
Synonyms: 1,1'-ethane-1,2-diylbis(3a,5,5,9b-tetramethyl-3a,4,5,9b-tetrahydronaphtho[1,2-d][1,3]oxazol-2(1H)-one)
Smiles: O=C1OC2(C(N1CCN1C(=O)OC3(C1(C)c1ccccc1C(C3)(C)C)C)(C)c1ccccc1C(C2)(C)C)C

STK781022
Synonyms: 1-{2-[(4-ethylphenyl)amino]-2-oxoethyl}-4-nitro-1H-pyrazole-3-carboxamide
Smiles: CCc1ccc(cc1)NC(=O)Cn1nc(c(c1)[N+](=O)[O-])C(=O)N

STK781024
Synonyms: N-methyl-N-{3-nitro-8-[(E)-phenyldiazenyl]dibenzo[b,f]oxepin-1-yl}acetamide
Smiles: CC(=O)N(c1cc(cc2c1C=Cc1c(O2)ccc(c1)/N=N/c1ccccc1)[N+](=O)[O-])C

STK781026
Synonyms: 6-(4-chlorophenyl)-2,4-dinitro-6,7-dihydro-5H-dibenzo[b,g][1,5]oxazocin-5-one
Smiles: Clc1ccc(cc1)N1Cc2ccccc2Oc2c(C1=O)c(cc(c2)[N+](=O)[O-])[N+](=O)[O-]

STK781029
Synonyms: N-(3-methoxyphenyl)-1-(methylsulfanyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Smiles: CSc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)Nc1cccc(c1)OC

STK781030
Synonyms: N-[4-(2H-benzotriazol-2-yl)phenyl]-2-fluoro-N-(propan-2-yl)benzamide
Smiles: CC(N(C(=O)c1ccccc1F)c1ccc(cc1)n1nc2c(n1)cccc2)C

STK781031
Synonyms: ethyl4-({4-[(4-methylcyclohexyl)oxy]-4-oxobutanoyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CCC(=O)OC1CCC(CC1)C

STK781032
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(3-chlorophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C)c1cccc(c1)Cl

STK781033
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(3-fluorophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C)c1cccc(c1)F

STK781034
Synonyms: 6-methoxy-1-(4-nitrophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline
Smiles: COc1ccc2c(c1)c1CCNC(c1[nH]2)c1ccc(cc1)[N+](=O)[O-]

STK781035
Synonyms: N-(3-chloro-4-fluorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazole-4-carboxamide
Smiles: O=C1Nc2nc3c(n2C(C1)C(=O)Nc1ccc(c(c1)Cl)F)cccc3

STK781036
Synonyms: ethyl[3'-acetyl-5-bromo-5'-(4-hydroxyphenyl)-2-oxo-3'H-spiro[indole-3,2'-[1,3,4]oxadiazol]-1(2H)-yl]acetate
Smiles: CCOC(=O)CN1c2ccc(cc2C2(C1=O)OC(=NN2C(=O)C)c1ccc(cc1)O)Br

STK781037
Synonyms: 4-{4-[(2-fluorobenzyl)oxy]phenyl}-6-methyl-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
Smiles: O=C1CC(c2ccc(cc2)OCc2ccccc2F)c2c(O1)c1ccccc1n(c2=O)C

STK781038
Synonyms: 2-({[(Z)-cyano(phenyl)methylidene]amino}oxy)-N-phenylacetamide
Smiles: N#C/C(=N\OCC(=O)Nc1ccccc1)/c1ccccc1

STK781039
Synonyms: 3-nitro-N-(1,3-thiazol-2-yl)dibenzo[b,f]oxepine-1-carboxamide
Smiles: [O-][N+](=O)c1cc2Oc3ccccc3C=Cc2c(c1)C(=O)Nc1nccs1

STK781040
Synonyms: ethyl6-methyl-2-oxo-3-(phenylacetyl)-4-[4-(propan-2-yloxy)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)OC(C)C)C(=O)Cc1ccccc1

STK781041
Synonyms: 1-[3-(cyclopentyloxy)phenyl]-6-methoxy-2,3,4,9-tetrahydro-1H-beta-carboline
Smiles: COc1ccc2c(c1)c1CCNC(c1[nH]2)c1cccc(c1)OC1CCCC1

STK781042
Synonyms: 6,8-dichloro-N-(4-methoxyphenyl)-3-nitrodibenzo[b,f]oxepine-1-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1cc(cc2c1C=Cc1c(O2)c(Cl)cc(c1)Cl)[N+](=O)[O-]

STK781045
Synonyms: 6-amino-2-{[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]sulfanyl}-1-(2-phenylethyl)pyrimidin-4(1H)-one
Smiles: O=c1cc(N)n(c(n1)SCC(=O)N1c2ccccc2Sc2c1cccc2)CCc1ccccc1

STK781046
Synonyms: 2-(4-nitro-1H-pyrazol-1-yl)-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]acetamide
Smiles: O=C(Nc1nnc(s1)CCc1ccccc1)Cn1ncc(c1)[N+](=O)[O-]

STK781051
Synonyms: {4-amino-2-[(4-methoxyphenyl)amino]-1,3-thiazol-5-yl}(4-methoxyphenyl)methanone
Smiles: COc1ccc(cc1)Nc1nc(c(s1)C(=O)c1ccc(cc1)OC)N

STK781052
Synonyms: 4-{5-[1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1,2,4-oxadiazol-3-yl}-2-methylquinoline
Smiles: Cc1nc2ccccc2c(c1)c1noc(n1)C(n1nc(c(c1C)[N+](=O)[O-])C)C

STK781054
Synonyms: N-(4-ethoxyphenyl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)Cn1nc(c(c1C)I)C

STK781055
Synonyms: N-(3,5-dichlorophenyl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)Nc1cc(Cl)cc(c1)Cl

STK781056
Synonyms: 2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)-N-(4-iodo-2-methylphenyl)acetamide
Smiles: Ic1ccc(c(c1)C)NC(=O)Cn1nc(c(c1C)I)C

STK781057
Synonyms: N-(3-chloro-4-fluorophenyl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)Nc1ccc(c(c1)Cl)F

STK781058
Synonyms: N-(4-fluorophenyl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)Nc1ccc(cc1)F

STK781059
Synonyms: N-(4-bromo-2-methylphenyl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)Nc1ccc(cc1C)Br

STK781061
Synonyms: N-(4-cyanophenyl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: N#Cc1ccc(cc1)NC(=O)Cn1nc(c(c1C)I)C

STK781062
Synonyms: N-(3-acetylphenyl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)Nc1cccc(c1)C(=O)C

STK781063
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: N#Cc1c(NC(=O)Cn2ncc(c2)I)sc2c1CCC2

STK781064
Synonyms: N-(1,3-benzodioxol-5-yl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)Nc1ccc2c(c1)OCO2

STK781065
Synonyms: N-(3,4-difluorophenyl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)Nc1ccc(c(c1)F)F

STK781066
Synonyms: (3Z)-3-[(dimethylamino)methylidene]-5-[(Z)-(5-oxofuran-2(5H)-ylidene)methyl]furan-2(3H)-one
Smiles: CN(/C=C\1/C=C(OC1=O)/C=C\1/C=CC(=O)O1)C

STK781067
Synonyms: 6-methyl-2-nitro-N-phenyl-1-benzothiophen-3-amine
Smiles: Cc1ccc2c(c1)sc(c2Nc1ccccc1)[N+](=O)[O-]

STK781069
Synonyms: (1Z)-2-(1H-benzimidazol-2-yl)-N'-hydroxyethanimidamide
Smiles: O/N=C(/Cc1nc2c([nH]1)cccc2)\N

STK781072
Synonyms: N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(trifluoromethyl)aniline
Smiles: Cc1ccn2c(c1)nc(c2)CNc1cccc(c1)C(F)(F)F

STK781073
Synonyms: N-[3-(imidazo[1,2-a]pyrimidin-2-yl)phenyl]-2-iodobenzamide
Smiles: O=C(c1ccccc1I)Nc1cccc(c1)c1cn2c(n1)nccc2

STK781075
Synonyms: N-(thiophen-2-ylmethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)C(F)(F)F)NCc1cccs1

STK781076
Synonyms: N-(2-phenylethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)C(F)(F)F)NCCc1ccccc1

STK781077
Synonyms: N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)C(F)(F)F)NCc1cccnc1

STK781078
Synonyms: N-(pyridin-4-ylmethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)C(F)(F)F)NCc1ccncc1

STK781079
Synonyms: N-[3-(1H-imidazol-1-yl)propyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)C(F)(F)F)NCCCn1cncc1

STK781080
Synonyms: N-(pyridin-2-ylmethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)C(F)(F)F)NCc1ccccn1

STK781081
Synonyms: N-[2-(1H-indol-3-yl)ethyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)C(F)(F)F)NCCc1c[nH]c2c1cccc2

STK781082
Synonyms: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(3,5-dimethoxybenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(CNC(=O)c2onc(n2)Cn2nc(c(c2C)Br)C)cc(c1)OC

STK781086
Synonyms: N-(2,1,3-benzoxadiazol-4-yl)-5-bromofuran-2-carboxamide
Smiles: Brc1ccc(o1)C(=O)Nc1cccc2c1non2

STK781088
Synonyms: 3-(3,4-dichlorophenyl)-1-(4-ethylphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea
Smiles: CCc1ccc(cc1)N(C(=O)Nc1ccc(c(c1)Cl)Cl)Cc1nnc2n1CCCCC2

STK781089
Synonyms: 1-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1-oxopropan-2-yl2-methylquinoline-4-carboxylate
Smiles: Cc1nc2ccccc2c(c1)C(=O)OC(C(=O)Nc1sc2c(c1C(=O)N)CCCC2)C

STK781090
Synonyms: 2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acetamide
Smiles: O=C(Nc1nnc(s1)C(F)(F)F)CSc1nnc2c(n1)n(CCc1ccccc1)c1c2cccc1

STK781091
Synonyms: 2-oxo-2-{[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]amino}ethyl2-methylquinoline-4-carboxylate
Smiles: O=C(Nc1nnc(s1)C(F)(F)F)COC(=O)c1cc(C)nc2c1cccc2

STK781092
Synonyms: 4-chloro-N-[2-(furan-2-ylmethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1ccc2c(c1)nc1n2CCN(C1)Cc1ccco1

STK781093
Synonyms: 3-bromo-N-[2-(furan-2-ylmethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]benzamide
Smiles: Brc1cccc(c1)C(=O)Nc1ccc2c(c1)nc1n2CCN(C1)Cc1ccco1

STK781094
Synonyms: 4-fluoro-N-[2-(furan-2-ylmethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1ccc2c(c1)nc1n2CCN(C1)Cc1ccco1

STK781095
Synonyms: N-[2-(furan-2-ylmethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]-2-phenoxyacetamide
Smiles: O=C(Nc1ccc2c(c1)nc1n2CCN(C1)Cc1ccco1)COc1ccccc1

STK781096
Synonyms: 2-(4-chlorophenoxy)-N-[2-(furan-2-ylmethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]acetamide
Smiles: O=C(Nc1ccc2c(c1)nc1n2CCN(C1)Cc1ccco1)COc1ccc(cc1)Cl

STK781097
Synonyms: [6-methoxy-1-(4-nitrophenyl)-1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl](phenyl)methanone
Smiles: COc1ccc2c(c1)c1CCN(C(c1[nH]2)c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccccc1

STK781098
Synonyms: ethyl5-methoxy-1-(3-methoxy-3-oxopropyl)-2-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c2cc(OC)ccc2n(c1C)CCC(=O)OC

STK781099
Synonyms: {6-bromo-5-methoxy-2-[(4-methoxyphenoxy)methyl]-1-methyl-1H-indol-3-yl}(piperidin-1-yl)methanone
Smiles: COc1ccc(cc1)OCc1c(C(=O)N2CCCCC2)c2c(n1C)cc(c(c2)OC)Br

STK781100
Synonyms: methyl2-amino-4-{4-[(1,3-benzothiazol-2-ylsulfanyl)methyl]thiophen-2-yl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: COC(=O)C1=C(N)OC2=C(C1c1scc(c1)CSc1nc3c(s1)cccc3)C(=O)CCC2

STK781103
Synonyms: N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]pyridine-4-carboxamide
Smiles: O=C(c1ccncc1)Nc1nc2c(s1)cc(cc2)S(=O)(=O)N(C)C

STK781106
Synonyms: N-(2-fluorophenyl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)Nc1ccccc1F

STK781108
Synonyms: 4,7,7-trimethyl-3-oxo-N-[4-(trifluoromethyl)phenyl]-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)Nc1ccc(cc1)C(F)(F)F

STK781110
Synonyms: N-(2,5-difluorophenyl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)Nc1cc(F)ccc1F

STK781111
Synonyms: N-(2,4-difluorophenyl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: Fc1ccc(c(c1)F)NC(=O)C12CCC(C2(C)C)(C(=O)O1)C

STK781112
Synonyms: N-(3,4-difluorophenyl)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)Nc1ccc(c(c1)F)F

STK781113
Synonyms: 4-[(6-fluoro-2-methyl-3,4-dihydroquinolin-1(2H)-yl)carbonyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
Smiles: Fc1ccc2c(c1)CCC(N2C(=O)C12CCC(C2(C)C)(C(=O)C1)C)C

STK781114
Synonyms: 4,7,7-trimethyl-3-oxo-N-[3-(trifluoromethyl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1)C)Nc1cccc(c1)C(F)(F)F

STK781116
Synonyms: N-(2,5-difluorophenyl)-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: Fc1ccc(c(c1)NC(=O)C12CCC(C2(C)C)(C(=O)C1)C)F

STK781117
Synonyms: N-(3,4-difluorophenyl)-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1)C)Nc1ccc(c(c1)F)F

STK781118
Synonyms: N-(4-fluorophenyl)-4,7,7-trimethyl-2,3-dioxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)Nc1ccc(cc1)F

STK781119
Synonyms: 4,7,7-trimethyl-2,3-dioxo-N-[4-(trifluoromethoxy)phenyl]bicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)Nc1ccc(cc1)OC(F)(F)F

STK781120
Synonyms: N-(2,5-difluorophenyl)-4,7,7-trimethyl-2,3-dioxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)Nc1cc(F)ccc1F

STK781121
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)CC1=O)Nc1cc(ccc1Cl)C(F)(F)F

STK781122
Synonyms: 1-[(6-fluoro-2-methyl-3,4-dihydroquinolin-1(2H)-yl)carbonyl]-7,7-dimethylbicyclo[2.2.1]heptan-2-one
Smiles: Fc1ccc2c(c1)CCC(N2C(=O)C12CCC(C2(C)C)CC1=O)C

STK781124
Synonyms: 3-(2-chloro-7-methylquinolin-3-yl)propanenitrile
Smiles: N#CCCc1cc2ccc(cc2nc1Cl)C

STK781125
Synonyms: N-(2-fluorophenyl)-4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxamide
Smiles: Fc1ccccc1NC(=O)C12CCC(C2(C)C)(c2c1nc1ccccc1n2)C

STK781126
Synonyms: 4,11,11-trimethyl-N-[4-(trifluoromethoxy)phenyl]-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxamide
Smiles: O=C(C12CCC(C2(C)C)(c2c1nc1ccccc1n2)C)Nc1ccc(cc1)OC(F)(F)F

STK781129
Synonyms: N-(4-fluorophenyl)-1H-benzimidazole-6-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1ccc2c(c1)[nH]cn2

STK781130
Synonyms: pyrido[3,2-f]quinoxaline
Smiles: c1ccc2c(n1)ccc1c2nccn1

STK781132
Synonyms: N,1-bis(4-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: COc1ccc(cc1)c1c(C(=S)Nc2ccc(cc2)OC)n2c3c1CCCCn3c(c2)c1ccc(cc1)C

STK781133
Synonyms: 5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Smiles: Cc1nn(c(c1Br)C)Cc1onc(n1)c1ccc(cc1)C(F)(F)F

STK781134
Synonyms: 5-[(2,4-difluorophenoxy)methyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Smiles: Fc1ccc(c(c1)F)OCc1onc(n1)c1ccc(cc1)C(F)(F)F

STK781136
Synonyms: 3-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridine
Smiles: FC(c1ccc(cc1)c1noc(n1)c1cccnc1)(F)F

STK781137
Synonyms: 5-[(4-nitro-1H-pyrazol-1-yl)methyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Smiles: [O-][N+](=O)c1cnn(c1)Cc1onc(n1)c1ccc(cc1)C(F)(F)F

STK781139
Synonyms: 5-(3,4-diethoxybenzyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Smiles: CCOc1cc(ccc1OCC)Cc1onc(n1)c1ccc(cc1)C(F)(F)F

STK781140
Synonyms: 5-(2-fluorobenzyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Smiles: Fc1ccccc1Cc1onc(n1)c1ccc(cc1)C(F)(F)F

STK781141
Synonyms: 5-[(4-methoxyphenoxy)methyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Smiles: COc1ccc(cc1)OCc1onc(n1)c1ccc(cc1)C(F)(F)F

STK781142
Synonyms: 1-(2-methylphenyl)-3-[2-(pyridin-4-yl)ethyl]urea
Smiles: O=C(Nc1ccccc1C)NCCc1ccncc1

STK781144
Synonyms: 2-({5,6-bis[4-(propan-2-yl)phenyl]-1,2,4-triazin-3-yl}sulfanyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Smiles: O=C(Nc1noc(c1)C)CSc1nnc(c(n1)c1ccc(cc1)C(C)C)c1ccc(cc1)C(C)C

STK781146
Synonyms: 2-amino-4-[4-(1H-benzimidazol-1-ylmethyl)thiophen-2-yl]-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1scc(c1)Cn1cnc3c1cccc3)C(=O)CC(C2)(C)C

STK781148
Synonyms: 6-amino-4-[4-(1H-benzimidazol-1-ylmethyl)thiophen-2-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1scc(c1)Cn1cnc3c1cccc3)c(C)[nH]n2

STK781151
Synonyms: 2-[(4-amino-6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(c(=O)n1N)C

STK781152
Synonyms: ethyl6-methyl-4-(4-nitrophenyl)-2-oxo-3-(phenylacetyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+](=O)[O-])C(=O)Cc1ccccc1

STK781153
Synonyms: N-[4-(2H-benzotriazol-2-yl)phenyl]-2,4-dichloro-N-(propan-2-yl)benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)N(c1ccc(cc1)n1nc2c(n1)cccc2)C(C)C

STK781155
Synonyms: 4-methyl-N-[2-(trifluoromethyl)-1H-benzimidazol-4-yl]benzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1cccc2c1nc([nH]2)C(F)(F)F

STK781156
Synonyms: 2-amino-4-[4-(1H-benzimidazol-1-ylmethyl)thiophen-2-yl]-1-(3-chlorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2cccc(c2)Cl)C2=C(C1c1scc(c1)Cn1cnc3c1cccc3)C(=O)CCC2

STK781162
Synonyms: (2E)-2-(3-nitrobenzylidene)-2,3-dihydro-1H-inden-1-one
Smiles: [O-][N+](=O)c1cccc(c1)/C=C/1\Cc2c(C1=O)cccc2

STK781163
Synonyms: ethyl4-(4-methoxyphenyl)-6-methyl-2-oxo-3-(phenylacetyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)OC)C(=O)Cc1ccccc1

STK781164
Synonyms: 4-(3'-acetyl-2-oxo-1,2-dihydro-3'H-spiro[indole-3,2'-[1,3,4]oxadiazol]-5'-yl)phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C1=NN(C2(O1)C(=O)Nc1c2cccc1)C(=O)C

STK781165
Synonyms: N-[2-(trifluoromethyl)-1H-benzimidazol-4-yl]-1,3-benzodioxole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)OCO2)Nc1cccc2c1nc([nH]2)C(F)(F)F

STK781166
Synonyms: 4-{3-[(2,4-difluorophenoxy)methyl]-4-methoxyphenyl}-3,4-dihydro-2H,5H-pyrano[3,2-c]chromene-2,5-dione
Smiles: COc1ccc(cc1COc1ccc(cc1F)F)C1CC(=O)Oc2c1c(=O)oc1c2cccc1

STK781167
Synonyms: 2-amino-4-(1H-indol-3-yl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c[nH]c3c1cccc3)c(=O)oc(c2)C

STK781168
Synonyms: 1-(2-methyl-5-nitrophenyl)-4-(5-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc(s1)C)C(=O)CCC2)c1cc(ccc1C)[N+](=O)[O-]

STK781169
Synonyms: 4-(2-fluorophenyl)-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
Smiles: O=C1CC(c2ccccc2F)c2c(O1)c1ccccc1[nH]c2=O

STK781170
Synonyms: 5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-3-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cscc1)C(=O)CCC2)c1cccc(c1)C(F)(F)F

STK781172
Synonyms: 5-oxo-4-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccnc1)C(=O)CCC2)c1ccccc1C(F)(F)F

STK781173
Synonyms: 4-(3-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1sccc1C)C(=O)CCC2)c1ccccc1C(F)(F)F

STK781174
Synonyms: 4-(3-fluorophenyl)-7,7-dimethyl-1-(4-methyl-2-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccc(c1)F)C(=O)CC(C2)(C)C)c1ccc(cc1[N+](=O)[O-])C

STK781175
Synonyms: 7,7-dimethyl-1-(4-methyl-2-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccs1)C(=O)CC(C2)(C)C)c1ccc(cc1[N+](=O)[O-])C

STK781176
Synonyms: 1-(4-methyl-2-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccs1)C(=O)CCC2)c1ccc(cc1[N+](=O)[O-])C

STK781177
Synonyms: 1-(4-methyl-2-nitrophenyl)-5-oxo-4-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccnc1)C(=O)CCC2)c1ccc(cc1[N+](=O)[O-])C

STK781178
Synonyms: 1-(4-methyl-2-nitrophenyl)-4-(5-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc(s1)C)C(=O)CCC2)c1ccc(cc1[N+](=O)[O-])C

STK781179
Synonyms: 7,7-dimethyl-1-(4-methyl-2-nitrophenyl)-4-(3-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1sccc1C)C(=O)CC(C2)(C)C)c1ccc(cc1[N+](=O)[O-])C

STK781180
Synonyms: 4-(3-fluorophenyl)-1-(2-methyl-5-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccc(c1)F)C(=O)CCC2)c1cc(ccc1C)[N+](=O)[O-]

STK781181
Synonyms: 7,7-dimethyl-1-(2-methyl-5-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccs1)C(=O)CC(C2)(C)C)c1cc(ccc1C)[N+](=O)[O-]

STK781183
Synonyms: 3-tert-butyl-7-[(4-chlorobenzyl)sulfanyl]-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Smiles: CC(c1nnc2n(c1=O)nc(s2)SCc1ccc(cc1)Cl)(C)C

STK781185
Synonyms: 1-(dimethylamino)-7,7-dimethyl-4-(2,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: COc1cc(OC)c(cc1C1CC(=O)N(C2=C1C(=O)CC(C2)(C)C)N(C)C)OC

STK781186
Synonyms: 2-amino-5-oxo-4-[2-(trifluoromethyl)phenyl]-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccccc1C(F)(F)F)c(=O)nc1n2ccs1

STK781187
Synonyms: 5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-2-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccs1)C(=O)CCC2)c1cccc(c1)C(F)(F)F

STK781188
Synonyms: 4-(5-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc(s1)C)C(=O)CCC2)c1ccccc1C(F)(F)F

STK781189
Synonyms: 1-[2-nitro-4-(trifluoromethyl)phenyl]-5-oxo-4-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccnc1)C(=O)CCC2)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

STK781191
Synonyms: 4-(4-ethylphenyl)-7-methyl-3,4-dihydro-2H-dipyrido[1,2-a:3',2'-e]pyrimidine-2,5(1H)-dione
Smiles: CCc1ccc(cc1)C1CC(=O)Nc2c1c(=O)nc1n2cccc1C

STK781192
Synonyms: 7-methyl-4-(3-nitrophenyl)-3,4-dihydro-2H-dipyrido[1,2-a:3',2'-e]pyrimidine-2,5(1H)-dione
Smiles: O=C1CC(c2cccc(c2)[N+](=O)[O-])c2c(N1)n1cccc(c1nc2=O)C

STK781196
Synonyms: [4-amino-2-(methylamino)-1,3-thiazol-5-yl](4-methoxyphenyl)methanone
Smiles: CNc1nc(c(s1)C(=O)c1ccc(cc1)OC)N

STK781198
Synonyms: 8-methyl-6-oxo-3,4-dihydro-2H,6H-pyrido[2,1-b][1,3]oxazine-9-carbonitrile
Smiles: N#Cc1c(C)cc(=O)n2c1OCCC2

STK781200
Synonyms: 4-(4-nitro-1H-pyrazol-1-yl)-1-(piperidin-1-yl)butan-1-one
Smiles: O=C(N1CCCCC1)CCCn1ncc(c1)[N+](=O)[O-]

STK781201
Synonyms: N-(5-chloro-2-methoxyphenyl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: COc1ccc(cc1NC(=O)Cn1ncc(c1)I)Cl

STK781202
Synonyms: N-(3-chlorophenyl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1ncc(c1)I)Nc1cccc(c1)Cl

STK781203
Synonyms: N-(2,3-dichlorophenyl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Nc1cccc(c1Cl)Cl)Cn1ncc(c1)I

STK781204
Synonyms: N-(2,5-dimethoxyphenyl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: COc1ccc(cc1NC(=O)Cn1ncc(c1)I)OC

STK781205
Synonyms: N-(3-chloro-4-methylphenyl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1ncc(c1)I)Nc1ccc(c(c1)Cl)C

STK781206
Synonyms: N-(4-bromo-2-methylphenyl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Nc1ccc(cc1C)Br)Cn1ncc(c1)I

STK781208
Synonyms: ethyl2-{[(4-iodo-1H-pyrazol-1-yl)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)Cn2ncc(c2)I)sc2c1CCC2

STK781209
Synonyms: N-(1,3-benzothiazol-2-yl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: Ic1cnn(c1)CC(=O)Nc1nc2c(s1)cccc2

STK781211
Synonyms: N-(1,3-benzodioxol-5-yl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1ncc(c1)I)Nc1ccc2c(c1)OCO2

STK781212
Synonyms: N-(2,5-difluorophenyl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Nc1cc(F)ccc1F)Cn1ncc(c1)I

STK781217
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1ccc(cc1OC)CCNC(=O)c1onc(n1)c1ccc(cc1)C(F)(F)F

STK781219
Synonyms: 3-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCC1CCCO1

STK781220
Synonyms: N-(2,1,3-benzoxadiazol-4-yl)thiophene-2-carboxamide
Smiles: O=C(c1cccs1)Nc1cccc2c1non2

STK781224
Synonyms: 4-bromo-1-ethyl-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1cccc(c1)C(F)(F)F)Br

STK781226
Synonyms: 4-bromo-1-ethyl-N-[4-(1,2-oxazol-5-yl)phenyl]-1H-pyrazole-5-carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1ccc(cc1)c1ccno1)Br

STK781227
Synonyms: 4-chloro-N-(2,4-dichlorophenyl)-1-ethyl-1H-pyrazole-3-carboxamide
Smiles: CCn1cc(c(n1)C(=O)Nc1ccc(cc1Cl)Cl)Cl

STK781228
Synonyms: N-(3-chlorophenyl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Smiles: CCn1nc(c(c1)[N+](=O)[O-])C(=O)Nc1cccc(c1)Cl

STK781229
Synonyms: 2-oxo-2-{[4-(thiophen-2-yl)-1,3-thiazol-2-yl]amino}ethyl2-(1,3-benzothiazol-2-yl)benzoate
Smiles: O=C(Nc1scc(n1)c1cccs1)COC(=O)c1ccccc1c1nc2c(s1)cccc2

STK781232
Synonyms: 1-(2-methyl-5-nitrophenyl)-5-oxo-4-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccnc1)C(=O)CCC2)c1cc(ccc1C)[N+](=O)[O-]

STK781236
Synonyms: 2-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)-N-(2-phenylethyl)acetamide
Smiles: O=C(Cn1nc(nc1Br)[N+](=O)[O-])NCCc1ccccc1

STK781238
Synonyms: 1,3-dimethyl-5,5-bis[2-oxo-2-(piperidin-1-yl)ethyl]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CN1C(=O)N(C)C(=O)C(C1=O)(CC(=O)N1CCCCC1)CC(=O)N1CCCCC1

STK781240
Synonyms: 8-[3-(diethylamino)phenoxy]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN(c1cccc(c1)Oc1nc2c(n1C)c(=O)n(c(=O)n2C)C)CC

STK781241
Synonyms: N,N-diethyl-3-methoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]benzamide
Smiles: CCN(C(=O)c1ccc(c(c1)OC)Oc1nnnn1c1ccccc1)CC

STK781242
Synonyms: 2-(5-{[1-(4-methylphenyl)-1H-tetrazol-5-yl]sulfanyl}-3-nitro-1H-1,2,4-triazol-1-yl)-1-(piperidin-1-yl)ethanone
Smiles: Cc1ccc(cc1)n1nnnc1Sc1nc(nn1CC(=O)N1CCCCC1)[N+](=O)[O-]

STK781243
Synonyms: 4-[({[4-(2-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CSc1nnc(n1c1ccccc1Cl)c1ccncc1

STK781245
Synonyms: N-(1,3-benzodioxol-5-yl)-2-[(1-oxophthalazin-2(1H)-yl)acetyl]hydrazinecarbothioamide
Smiles: O=C(Cn1ncc2c(c1=O)cccc2)NNC(=S)Nc1ccc2c(c1)OCO2

STK781246
Synonyms: 4-(5-chloro-2-methoxyphenyl)-5-(quinolin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1n1c(S)nnc1c1ccc2c(n1)cccc2)Cl

STK781247
Synonyms: 4-[1-(4-chlorophenyl)ethyl]-5-(quinolin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(cc1)C(n1c(S)nnc1c1ccc2c(n1)cccc2)C

STK781248
Synonyms: 6-amino-1,4-diphenyl-2-thioxo-1,2-dihydropyrimidine-5-carbonitrile
Smiles: N#Cc1c(nc(=S)n(c1N)c1ccccc1)c1ccccc1

STK781249
Synonyms: N-(5-chloro-2-methoxyphenyl)-2-[(1-oxophthalazin-2(1H)-yl)acetyl]hydrazinecarbothioamide
Smiles: COc1ccc(cc1NC(=S)NNC(=O)Cn1ncc2c(c1=O)cccc2)Cl

STK781250
Synonyms: 3-hydroxy-5-(4-hydroxyphenyl)-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Oc1ccc(cc1)C1NC(=O)C(=C1C(=O)c1cccs1)O

STK781251
Synonyms: 3-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenol
Smiles: Oc1cccc(c1)Oc1nnnn1c1ccccc1

STK781252
Synonyms: 5-{4-[2-(4-methoxyphenyl)propan-2-yl]phenoxy}-1-methyl-3-nitro-1H-1,2,4-triazole
Smiles: COc1ccc(cc1)C(c1ccc(cc1)Oc1nc(nn1C)[N+](=O)[O-])(C)C

STK781253
Synonyms: ethyl3-{[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)CN1C(=O)C2C(C1=O)CC=CC2

STK781254
Synonyms: 2-(2,5-dioxopyrrolidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(CN1C(=O)CCC1=O)Nc1cccc(c1)C(F)(F)F

STK781255
Synonyms: 8-(3-bromophenoxy)-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(Oc2cccc(c2)Br)nc2c1c(=O)n(c(=O)n2C)C

STK781258
Synonyms: 4-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}-3,4-dihydro-2H,5H-pyrano[3,2-c]chromene-2,5-dione
Smiles: COc1ccc(cc1COc1ccc(c(c1)C)[N+](=O)[O-])C1CC(=O)Oc2c1c(=O)oc1c2cccc1

STK781259
Synonyms: 4-(5-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc(s1)C)C(=O)CCC2)c1cccc(c1)C(F)(F)F

STK781260
Synonyms: 1-[2-nitro-4-(trifluoromethyl)phenyl]-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccs1)C(=O)CCC2)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

STK781261
Synonyms: 1-(4-bromo-2-methylphenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cscc1)C(=O)CC(C2)(C)C)c1ccc(cc1C)Br

STK781262
Synonyms: 1-(5-bromopyridin-2-yl)-4-(3-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(c2ccc(cn2)Br)C2=C(C1c1sccc1C)C(=O)CCC2

STK781263
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(2-cyanophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C)c1ccccc1C#N

STK781265
Synonyms: ethyl2-methyl-4-[4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1scc(c1)CN1CCOCC1)C(=O)CCC2

STK781268
Synonyms: 4,6-dimethyl-3-[4,4,4-trifluoro-3-(morpholin-4-yl)butanoyl]pyridin-2(1H)-one
Smiles: O=C(c1c(C)cc([nH]c1=O)C)CC(C(F)(F)F)N1CCOCC1

STK781270
Synonyms: 3-(thiophen-2-yl)-5-(trichloromethyl)-1,2-oxazole
Smiles: ClC(c1onc(c1)c1cccs1)(Cl)Cl

STK781273
Synonyms: ethyl2-methyl-4-(4-{[(1-methyl-1H-imidazol-2-yl)sulfanyl]methyl}thiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1scc(c1)CSc1nccn1C)C(=O)CCC2

STK781274
Synonyms: 2-amino-4-[4-(1H-benzimidazol-1-ylmethyl)thiophen-2-yl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1scc(c1)Cn1cnc3c1cccc3)C(=O)CCC2

STK781275
Synonyms: ethyl6-amino-4-[4-(1H-benzimidazol-1-ylmethyl)thiophen-2-yl]-5-cyano-2-methyl-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1scc(c1)Cn1cnc2c1cccc2)C#N)N

STK781276
Synonyms: methyl6-amino-5-cyano-4-(2-ethoxyphenyl)-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate
Smiles: CCOc1ccccc1C1C(=C(CC(=O)OC)OC(=C1C#N)N)C(=O)OC

STK781277
Synonyms: 3-(thiophen-2-yl)-5-(trifluoromethyl)-1H-pyrazole
Smiles: FC(c1[nH]nc(c1)c1cccs1)(F)F

STK781279
Synonyms: 2-(2,6-dimethylmorpholin-4-yl)-N-[4-(morpholin-4-ylsulfonyl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N1CCOCC1)CN1CC(C)OC(C1)C

STK781280
Synonyms: 2-(2,6-dimethylmorpholin-4-yl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)c1nc2c(s1)cc(cc2)C)CN1CC(C)OC(C1)C

STK781282
Synonyms: 2,2'-[(4-cyano-1,2-thiazole-3,5-diyl)disulfanediyl]bis[N-(2-chlorophenyl)acetamide]
Smiles: N#Cc1c(SCC(=O)Nc2ccccc2Cl)snc1SCC(=O)Nc1ccccc1Cl

STK781283
Synonyms: 2-[(2-chlorobenzyl)sulfanyl]-5-(2-chlorophenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Smiles: O=C1Nc2nc(SCc3ccccc3Cl)[nH]c(=O)c2C(C1)c1ccccc1Cl

STK781284
Synonyms: 5-(2-chloro-6-fluorophenyl)-2-(ethylsulfanyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Smiles: CCSc1nc2NC(=O)CC(c2c(=O)[nH]1)c1c(F)cccc1Cl

STK781285
Synonyms: ethyl1-(2-fluorophenyl)-4-(4-methoxyphenyl)-2,5-dioxo-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Smiles: CCOC(=O)C1C(=O)C2=C(CC1c1cccs1)N(C(=O)CC2c1ccc(cc1)OC)c1ccccc1F

STK781286
Synonyms: ethyl4-(3-nitrophenyl)-2,5-dioxo-1-phenyl-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2c1ccccc1)c1cccc(c1)[N+](=O)[O-])c1cccs1

STK781291
Synonyms: 2-fluoro-N-(1-phenyl-1H-pyrazol-3-yl)benzamide
Smiles: O=C(c1ccccc1F)Nc1ccn(n1)c1ccccc1

STK781292
Synonyms: 1-[2-methyl-5-(3-nitrophenyl)-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3,4-oxadiazol-3(2H)-yl]ethanone
Smiles: CC(=O)N1N=C(OC1(C)C12CC3CC(C2)CC(C1)C3)c1cccc(c1)[N+](=O)[O-]

STK781294
Synonyms: 3-(trifluoromethyl)-N-[2-(trifluoromethyl)-1H-benzimidazol-4-yl]benzamide
Smiles: O=C(c1cccc(c1)C(F)(F)F)Nc1cccc2c1nc([nH]2)C(F)(F)F

STK781295
Synonyms: (2E)-2-cyano-2-{[2-oxo-2-(phenylamino)ethoxy]imino}-N-phenylethanamide
Smiles: N#C/C(=N\OCC(=O)Nc1ccccc1)/C(=O)Nc1ccccc1

STK781297
Synonyms: N-[3-(hexyloxy)phenyl]-2,5-dioxo-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: CCCCCCOc1cccc(c1)NC(=O)c1cc2C(=O)CCCc2n(c1=O)c1ccccc1

STK781298
Synonyms: N-[3-(hexyloxy)phenyl]-1-(4-methoxyphenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: CCCCCCOc1cccc(c1)NC(=O)c1cc2C(=O)CC(Cc2n(c1=O)c1ccc(cc1)OC)(C)C

STK781299
Synonyms: 1-(3-chlorophenyl)-N-[3-(hexyloxy)phenyl]-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: CCCCCCOc1cccc(c1)NC(=O)c1cc2C(=O)CC(Cc2n(c1=O)c1cccc(c1)Cl)(C)C

STK781303
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-methoxyphenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: COc1cc(CCNC(=O)c2cc3C(=O)CC(Cc3n(c2=O)c2ccccc2OC)(C)C)ccc1OC

STK781304
Synonyms: ethyl1-(4-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}phenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)c1cc2C(=O)CCCc2n(c1=O)c1ccc(cc1)C(=O)NCCc1ccc(c(c1)OC)OC

STK781311
Synonyms: 4-chloro-N-[2-(trifluoromethyl)-1H-benzimidazol-7-yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1cccc2c1[nH]c(n2)C(F)(F)F

STK781315
Synonyms: 2-(2,3-dihydro-1,4-benzodioxin-2-yl)-1-(4-methylpiperazin-1-yl)ethanone
Smiles: CN1CCN(CC1)C(=O)CC1COc2c(O1)cccc2

STK781317
Synonyms: ethyl4-{[(4-iodo-1H-pyrazol-1-yl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)Cn1ncc(c1)I

STK781318
Synonyms: 2-(4-iodo-1H-pyrazol-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Cn1ncc(c1)I)Nc1cccc(c1)C(F)(F)F

STK781319
Synonyms: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: N#Cc1c(NC(=O)Cn2nc(c(c2C)I)C)sc2c1CCC2

STK781320
Synonyms: N-(3,4-dimethoxybenzyl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: COc1cc(CNC(=O)Cn2ncc(c2)I)ccc1OC

STK781321
Synonyms: N-cycloheptyl-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NC1CCCCCC1

STK781323
Synonyms: N-(1H-benzimidazol-2-ylmethyl)-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)propanamide
Smiles: O=C(C(n1nc(c(c1C)Br)[N+](=O)[O-])C)NCc1nc2c([nH]1)cccc2

STK781326
Synonyms: N-(2-phenylethyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NCCc1ccccc1

STK781327
Synonyms: N-(pyridin-3-ylmethyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NCc1cccnc1

STK781328
Synonyms: N-(2-fluorobenzyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NCc1ccccc1F

STK781331
Synonyms: N-(1H-benzimidazol-2-ylmethyl)-4-(3-nitro-1H-pyrazol-1-yl)butanamide
Smiles: O=C(NCc1nc2c([nH]1)cccc2)CCCn1ccc(n1)[N+](=O)[O-]

STK781333
Synonyms: N-(pyridin-2-ylmethyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NCc1ccccn1

STK781334
Synonyms: 3-(3,4-dimethoxyphenyl)-N-[(2-methylquinolin-4-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NCc1cc(C)nc2c1cccc2

STK781336
Synonyms: 3-(3,4-dimethoxyphenyl)-N-(1-phenylethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NC(c1ccccc1)C

STK781338
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1ncc(c1)I)NCCc1nc2c([nH]1)cccc2

STK781339
Synonyms: 3-(1,3-benzodioxol-5-yl)-N-(2-phenylethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)OCO2)NCCc1ccccc1

STK781344
Synonyms: 3-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-(2-phenylethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCCc1ccccc1

STK781346
Synonyms: N-[3-(1H-imidazol-1-yl)propyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCCCn1cncc1

STK781348
Synonyms: N-(2-hydroxy-2-phenylethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: OC(c1ccccc1)CNC(=O)c1onc(n1)c1ccc(cc1)C(F)(F)F

STK781349
Synonyms: 3-[4-(trifluoromethyl)phenyl]-N-(3,4,5-trimethoxybenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(CNC(=O)c2onc(n2)c2ccc(cc2)C(F)(F)F)cc(c1OC)OC

STK781352
Synonyms: N-(2-hydroxy-2-phenylethyl)-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCC(c1ccccc1)O

STK781354
Synonyms: N-(3-fluorobenzyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: Fc1cccc(c1)CNC(=O)c1onc(n1)c1ccc(cc1)n1cccc1

STK781357
Synonyms: 3-[4-(1H-pyrrol-1-yl)phenyl]-N-{2-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-yloxy]ethyl}-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NCCOC12C[C@@H]3C[C@H](C2)C[C@H](C1)C3

STK781359
Synonyms: ethyl3-(2-chlorophenyl)-3-({[5-(thiophen-2-yl)-2H-tetrazol-2-yl]acetyl}amino)propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)Cn1nnc(n1)c1cccs1

STK781363
Synonyms: 3-(3-methoxyphenyl)-N-[3-(2-methyl-1H-imidazol-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cccc(c1)c1noc(n1)C(=O)NCCCn1ccnc1C

STK781364
Synonyms: N-(1H-benzimidazol-2-ylmethyl)-2-(4-fluorophenoxy)acetamide
Smiles: O=C(NCc1nc2c([nH]1)cccc2)COc1ccc(cc1)F

STK781368
Synonyms: N-(1H-benzimidazol-2-ylmethyl)-2-methylquinoline-4-carboxamide
Smiles: Cc1nc2ccccc2c(c1)C(=O)NCc1nc2c([nH]1)cccc2

STK781370
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(4-fluorophenoxy)acetamide
Smiles: O=C(COc1ccc(cc1)F)NCCc1nc2c([nH]1)cccc2

STK781371
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-3-chloro-1-benzothiophene-2-carboxamide
Smiles: O=C(c1sc2c(c1Cl)cccc2)NCCc1nc2c([nH]1)cccc2

STK781372
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2,4-difluorophenoxy)acetamide
Smiles: O=C(COc1ccc(cc1F)F)NCCc1nc2c([nH]1)cccc2

STK781373
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-5-bromofuran-2-carboxamide
Smiles: Brc1ccc(o1)C(=O)NCCc1nc2c([nH]1)cccc2

STK781374
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-1,3-benzodioxole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)OCO2)NCCc1nc2c([nH]1)cccc2

STK781376
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
Smiles: O=C(c1c(C)onc1c1ccccc1Cl)NCCc1nc2c([nH]1)cccc2

STK781377
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)NCCc1nc2c([nH]1)cccc2

STK781379
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-fluorophenyl)acetamide
Smiles: O=C(Cc1ccccc1F)NCCc1nc2c([nH]1)cccc2

STK781381
Synonyms: N-cyclohexyl-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NC1CCCCC1

STK781382
Synonyms: 3-(3,4-dimethoxyphenyl)-N-(propan-2-yl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NC(C)C

STK781383
Synonyms: N-(1-phenylethyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NC(c1ccccc1)C

STK781384
Synonyms: 3-[4-(1H-pyrrol-1-yl)phenyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NCC12CC3CC(C2)CC(C1)C3

STK781385
Synonyms: 3-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(CNC(=O)c2onc(n2)c2ccc3c(c2)OCO3)cc(c1)OC

STK781386
Synonyms: N-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)C(F)(F)F)NCC12CC3CC(C2)CC(C1)C3

STK781387
Synonyms: 1-(2-methylprop-2-en-1-yl)-6-propyl-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCCN1CNc2c(C1)c(=O)[nH]c(=S)n2CC(=C)C

STK781389
Synonyms: 1-(4-chlorophenyl)-6-(2-methoxyethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COCCN1CNc2c(C1)c(=O)[nH]c(=S)n2c1ccc(cc1)Cl

STK781390
Synonyms: 3-(1,3-benzodioxol-5-yl)-N-(3-fluorobenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Fc1cccc(c1)CNC(=O)c1onc(n1)c1ccc2c(c1)OCO2

STK781391
Synonyms: 3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: [O-][N+](=O)c1cnn(c1)Cc1noc(n1)C(=O)N

STK781393
Synonyms: N-benzyl-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NCc1ccccc1

STK781394
Synonyms: N-cycloheptyl-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NC1CCCCCC1

STK781395
Synonyms: N-[2-(2-methoxyphenyl)ethyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1ccccc1CCNC(=O)c1onc(n1)c1ccc(cc1)n1cccc1

STK781397
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(CCNC(=O)c2onc(n2)c2ccc(cc2)n2cccc2)ccc1OC

STK781399
Synonyms: 6-[2-(3,4-dimethoxyphenyl)ethyl]-1-(furan-2-ylmethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1cc(CCN2CNc3c(C2)c(=O)[nH]c(=S)n3Cc2ccco2)ccc1OC

STK781400
Synonyms: {[6-amino-4-oxo-1-(2-phenylethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetonitrile
Smiles: N#CCSc1nc(=O)cc(n1CCc1ccccc1)N

STK781401
Synonyms: 3-(1,3-benzodioxol-5-yl)-N-[3-(2-methyl-1H-imidazol-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)OCO2)NCCCn1ccnc1C

STK781402
Synonyms: N-[3-(2-methyl-1H-imidazol-1-yl)propyl]-3-(thiophen-2-yl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1cccs1)NCCCn1ccnc1C

STK781403
Synonyms: N-[3-(2-methyl-1H-imidazol-1-yl)propyl]-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)C(F)(F)F)NCCCn1ccnc1C

STK781404
Synonyms: N-[3-(2-methyl-1H-imidazol-1-yl)propyl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCCCn1ccnc1C

STK781405
Synonyms: 3-(3,4-dimethoxyphenyl)-N-[3-(2-methyl-1H-imidazol-1-yl)propyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NCCCn1ccnc1C

STK781409
Synonyms: 2-amino-4-(3-fluorophenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cccc(c1)F)c(=O)nc1n2ccs1

STK781410
Synonyms: 7,7-dimethyl-1-(2-methyl-5-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cscc1)C(=O)CC(C2)(C)C)c1cc(ccc1C)[N+](=O)[O-]

STK781411
Synonyms: 1-(3-chloro-4-fluorophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccs1)C(=O)CC(C2)(C)C)c1ccc(c(c1)Cl)F

STK781412
Synonyms: 1-(3-chloro-4-fluorophenyl)-7,7-dimethyl-4-(3-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(c2ccc(c(c2)Cl)F)C2=C(C1c1sccc1C)C(=O)CC(C2)(C)C

STK781413
Synonyms: 1-(4-bromo-2-methylphenyl)-4-(3-fluorophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccc(c1)F)C(=O)CCC2)c1ccc(cc1C)Br

STK781414
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(4-methylphenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1ccc(cc1)C

STK781415
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(3-chlorophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1cccc(c1)Cl

STK781416
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(3-bromophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1cccc(c1)Br

STK781417
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(2-chloro-5-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1cc(ccc1Cl)[N+](=O)[O-]

STK781418
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(4-cyanophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1ccc(cc1)C#N

STK781419
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(4-methoxy-2-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1ccc(c(c1)[N+](=O)[O-])N1C2=C(C(=O)CCC2)C(C(=C1n1cccc1)C#N)c1ccc2c(c1)OCO2

STK781420
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(2-methyl-5-nitrophenyl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1cc(ccc1C)[N+](=O)[O-]

STK781421
Synonyms: 4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C)c1cccnc1

STK781425
Synonyms: 6-(2,3-dichlorophenyl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione
Smiles: O=C1CC(c2cccc(c2Cl)Cl)c2c(N1)n1ncnc1[nH]c2=O

STK781428
Synonyms: 4-(2,3-dichlorophenyl)-7-methyl-3,4-dihydro-2H-dipyrido[1,2-a:3',2'-e]pyrimidine-2,5(1H)-dione
Smiles: O=C1CC(c2cccc(c2Cl)Cl)c2c(N1)n1cccc(c1nc2=O)C

STK781430
Synonyms: 4-(2,3-dimethoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-2,5(1H)-dione
Smiles: COc1c(OC)cccc1C1CC(=O)Nc2c1c(=O)nc1n2ccs1

STK781431
Synonyms: 4-(2,5-dimethoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-2,5(1H)-dione
Smiles: COc1ccc(cc1C1CC(=O)Nc2c1c(=O)nc1n2ccs1)OC

STK781432
Synonyms: 4-[4-(methylsulfanyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-2,5(1H)-dione
Smiles: CSc1ccc(cc1)C1CC(=O)Nc2c1c(=O)nc1n2ccs1

STK781434
Synonyms: 7'-amino-2'-[(4-fluorobenzyl)sulfanyl]-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Smiles: N#CC1=C(N)Nc2c(C31C(=O)Nc1c3cccc1)c(=O)[nH]c(n2)SCc1ccc(cc1)F

STK781435
Synonyms: 7'-amino-2'-[(4-fluorobenzyl)sulfanyl]-1-methyl-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Smiles: N#CC1=C(N)Nc2c(C31c1ccccc1N(C3=O)C)c(=O)[nH]c(n2)SCc1ccc(cc1)F

STK781436
Synonyms: 7'-amino-1-ethyl-2'-[(2-fluorobenzyl)sulfanyl]-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Smiles: CCN1c2ccccc2C2(C1=O)C(=C(N)Nc1c2c(=O)[nH]c(n1)SCc1ccccc1F)C#N

STK781437
Synonyms: 7'-amino-1-benzyl-2'-(methylsulfanyl)-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Smiles: N#CC1=C(N)Nc2c(C31c1ccccc1N(C3=O)Cc1ccccc1)c(=O)[nH]c(n2)SC

STK781438
Synonyms: 7'-amino-1-(3-fluorobenzyl)-2'-(methylsulfanyl)-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Smiles: N#CC1=C(N)Nc2c(C31c1ccccc1N(C3=O)Cc1cccc(c1)F)c(=O)[nH]c(n2)SC

STK781439
Synonyms: 7'-amino-1-(2-fluorobenzyl)-2'-(methylsulfanyl)-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Smiles: N#CC1=C(N)Nc2c(C31c1ccccc1N(C3=O)Cc1ccccc1F)c(=O)[nH]c(n2)SC

STK781441
Synonyms: 4-(2,3-dimethoxyphenyl)-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
Smiles: COc1c(OC)cccc1C1CC(=O)Oc2c1c(=O)[nH]c1c2cccc1

STK781442
Synonyms: 4-(2,4-dimethoxyphenyl)-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
Smiles: COc1cc(OC)ccc1C1CC(=O)Oc2c1c(=O)[nH]c1c2cccc1

STK781444
Synonyms: 5-(4-methoxyphenyl)-1,3-dimethyl-6-(pyridin-2-yl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: COc1ccc(cc1)c1n(cc2c1c(=O)n(C)c(=O)n2C)c1ccccn1

STK781445
Synonyms: 6-(2-ethoxyphenyl)-1,3-dimethyl-5-(4-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: CCOc1ccccc1n1cc2c(c1c1ccc(cc1)C)c(=O)n(c(=O)n2C)C

STK781446
Synonyms: methyl2-[1,3-dimethyl-5-(3-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]benzoate
Smiles: COC(=O)c1ccccc1n1cc2c(c1c1cccc(c1)C)c(=O)n(c(=O)n2C)C

STK781448
Synonyms: 5-(4-tert-butylphenyl)-1,3-dimethyl-6-(pyridin-2-yl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Cn1c(=O)c2c(c3ccc(cc3)C(C)(C)C)n(cc2n(c1=O)C)c1ccccn1

STK781449
Synonyms: 6-benzyl-5-(4-chlorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Clc1ccc(cc1)c1n(Cc2ccccc2)cc2c1c(=O)n(c(=O)n2C)C

STK781450
Synonyms: 6-(2-aminophenyl)-5-(4-chlorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Clc1ccc(cc1)c1n(cc2c1c(=O)n(C)c(=O)n2C)c1ccccc1N

STK781451
Synonyms: 5-(4-chlorophenyl)-6-(2-hydroxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Clc1ccc(cc1)c1n(cc2c1c(=O)n(C)c(=O)n2C)c1ccccc1O

STK781452
Synonyms: 6-(8-aminonaphthalen-1-yl)-5-(4-chlorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Clc1ccc(cc1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1cccc2c1c(N)ccc2

STK781453
Synonyms: ethyl[5-(4-chlorophenyl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]acetate
Smiles: CCOC(=O)Cn1cc2c(c1c1ccc(cc1)Cl)c(=O)n(c(=O)n2C)C

STK781454
Synonyms: 5-(4-chlorophenyl)-1,3-dimethyl-6-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Clc1ccc(cc1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1cccc(c1)C(F)(F)F

STK781455
Synonyms: 5-(4-chlorophenyl)-1,3-dimethyl-6-(pyridin-2-yl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Clc1ccc(cc1)c1n(cc2c1c(=O)n(C)c(=O)n2C)c1ccccn1

STK781456
Synonyms: 5-(4-chlorophenyl)-1,3-dimethyl-6-(2-phenylethyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Clc1ccc(cc1)c1n(CCc2ccccc2)cc2c1c(=O)n(c(=O)n2C)C

STK781457
Synonyms: 5-(4-chlorophenyl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Clc1ccc(cc1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1ccc2c(c1)OCCO2

STK781458
Synonyms: 6-(2-aminophenyl)-5-(2-chlorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Nc1ccccc1n1cc2c(c1c1ccccc1Cl)c(=O)n(c(=O)n2C)C

STK781459
Synonyms: 6-(2-hydroxyethyl)-1,3-dimethyl-5-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: OCCn1cc2c(c1c1cccc(c1)[N+](=O)[O-])c(=O)n(c(=O)n2C)C

STK781460
Synonyms: 1,3-dimethyl-5-(3-nitrophenyl)-6-(pyridin-2-yl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: [O-][N+](=O)c1cccc(c1)c1n(cc2c1c(=O)n(C)c(=O)n2C)c1ccccn1

STK781463
Synonyms: 4-(5-methoxy-1-methyl-1H-indol-3-yl)-3,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: COc1ccc2c(c1)c(cn2C)C1NC(=Nc2n1c1ccccc1n2)N

STK781464
Synonyms: 5-(4-bromophenyl)-6-(1,2-dimethyl-1H-benzimidazol-5-yl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Brc1ccc(cc1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1ccc2c(c1)nc(n2C)C