FULL DB

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

STK676780
Synonyms: 4-acetyl-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-5-(2-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccccc1[N+](=O)[O-])CCN1CCOCC1

STK676781
Synonyms: 1,1'-{6-hydroxy-4-[(4-methoxyphenyl)amino]-6-methyl-2-(3-nitrophenyl)cyclohex-3-ene-1,3-diyl}diethanone
Smiles: COc1ccc(cc1)NC1=C(C(=O)C)C(C(C(C1)(C)O)C(=O)C)c1cccc(c1)[N+](=O)[O-]

STK676782
Synonyms: 2-cyano-3-(6-hydroxy-2,2-dimethyl-4-oxo-4H-1,3-dioxin-5-yl)-3-phenylpropanamide
Smiles: N#CC(C(C1=C(O)OC(OC1=O)(C)C)c1ccccc1)C(=O)N

STK676784
Synonyms: 2-{[3-cyano-4-(pyridin-4-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccccc2C)nc2c(c1c1ccncc1)CCCC2

STK676786
Synonyms: 1,3-dimethyl-4-phenylpiperidin-4-ylpropanoate
Smiles: CCC(=O)OC1(CCN(CC1C)C)c1ccccc1

STK676788
Synonyms: 2-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridine-3-carbonitrile
Smiles: N#Cc1c(SC2CC(=O)N(C2=O)c2ccc(cc2)Br)nc(cc1C(F)(F)F)c1cccs1

STK676791
Synonyms: 4,6-bis[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-N-phenyl-1,3,5-triazin-2-amine
Smiles: FC(C(C(F)(F)F)Oc1nc(nc(n1)OC(C(F)(F)F)C(F)(F)F)Nc1ccccc1)(F)F

STK676792
Synonyms: 6-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-3-(heptafluoropropyl)[1,2,4]triazolo[4,3-b]pyridazine
Smiles: Cc1cc(C)nc(n1)Sc1ccc2n(n1)c(nn2)C(C(C(F)(F)F)(F)F)(F)F

STK676794
Synonyms: N-benzyl-4,6-bis[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-1,3,5-triazin-2-amine
Smiles: FC(C(C(F)(F)F)Oc1nc(NCc2ccccc2)nc(n1)OC(C(F)(F)F)C(F)(F)F)(F)F

STK676795
Synonyms: 4,6-bis[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-N-(pyridin-3-yl)-1,3,5-triazin-2-amine
Smiles: FC(C(C(F)(F)F)Oc1nc(Nc2cccnc2)nc(n1)OC(C(F)(F)F)C(F)(F)F)(F)F

STK676796
Synonyms: N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridine-2-carboxamide
Smiles: O=C(c1ccccn1)NC1CC(C)(C)NC(C1)(C)C

STK676797
Synonyms: 5-(1,3-benzodioxol-5-yl)-3-hydroxy-4-[(4-methylphenyl)carbonyl]-1-(pyridin-3-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc2c(c1)OCO2)Cc1cccnc1

STK676799
Synonyms: 4-{[(2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-yl)carbonyl]amino}benzoicacid
Smiles: O=C(c1c(C)oc2c1CCCC2)Nc1ccc(cc1)C(=O)O

STK676802
Synonyms: 6-(2-chloroethoxy)-3-methyl-1,5-dinitro-3-azabicyclo[3.3.1]non-6-ene
Smiles: ClCCOC1=CCC2(CC1(CN(C2)C)[N+](=O)[O-])[N+](=O)[O-]

STK676803
Synonyms: 5-(1,3-benzodioxol-5-yl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CN(CCN1C(c2ccc3c(c2)OCO3)C(=C(C1=O)O)C(=O)c1ccccc1)C

STK676804
Synonyms: 3-{3-hydroxy-5-(4-methoxyphenyl)-4-[(4-methylphenyl)carbonyl]-2-oxo-2,5-dihydro-1H-pyrrol-1-yl}propanoicacid
Smiles: COc1ccc(cc1)C1N(CCC(=O)O)C(=O)C(=C1C(=O)c1ccc(cc1)C)O

STK676805
Synonyms: 4-acetyl-5-(4-bromophenyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Brc1ccc(cc1)C1N(CCN2CCOCC2)C(=O)C(=C1C(=O)C)O

STK676807
Synonyms: methyl2-(2-hydroxy-2-propylpentanoyl)-1-(4-methylphenyl)hydrazinecarboxylate
Smiles: CCCC(C(=O)NN(c1ccc(cc1)C)C(=O)OC)(CCC)O

STK676809
Synonyms: 1-(4-ethoxyphenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: CCOc1ccc(cc1)C1NCCc2c1cc(OC)c(c2)OC

STK676810
Synonyms: 4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-2-ethoxyphenol
Smiles: CCOc1cc(ccc1O)C1NCCc2c1cc(OC)c(c2)OC

STK676811
Synonyms: 5-(2,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(OC)ccc1C1N(CCN(C)C)C(=O)C(=C1C(=O)c1ccccc1)O

STK676812
Synonyms: 3-[(2-chloro-4-fluorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazole
Smiles: Fc1ccc(c(c1)Cl)CSc1nncn1C

STK676816
Synonyms: ethyl4-{3-[4-(4-chlorobenzyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)Cc1ccc(cc1)Cl

STK676817
Synonyms: 2-(4,6-diphenylpyridin-2-yl)-1H-indene-1,3(2H)-dione
Smiles: O=C1C(c2cc(cc(n2)c2ccccc2)c2ccccc2)C(=O)c2c1cccc2

STK676818
Synonyms: 3-[4-(4-chlorobenzyl)piperazin-1-yl]-1-(4-iodophenyl)pyrrolidine-2,5-dione
Smiles: Clc1ccc(cc1)CN1CCN(CC1)C1CC(=O)N(C1=O)c1ccc(cc1)I

STK676819
Synonyms: ethyl4-[2,5-dioxo-3-(4-phenylpiperazin-1-yl)pyrrolidin-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)c1ccccc1

STK676820
Synonyms: 1-(4-bromophenyl)-3-[4-(4-chlorobenzyl)piperazin-1-yl]pyrrolidine-2,5-dione
Smiles: Clc1ccc(cc1)CN1CCN(CC1)C1CC(=O)N(C1=O)c1ccc(cc1)Br

STK676821
Synonyms: 1-(4-methoxyphenyl)-3-[(3-phenylpropyl)amino]pyrrolidine-2,5-dione
Smiles: COc1ccc(cc1)N1C(=O)CC(C1=O)NCCCc1ccccc1

STK676822
Synonyms: 1-(3-ethoxyphenyl)-3-(octylamino)pyrrolidine-2,5-dione
Smiles: CCCCCCCCNC1CC(=O)N(C1=O)c1cccc(c1)OCC

STK676824
Synonyms: 2-(2-chloro-6-methylphenyl)-5-methyl-1H-isoindole-1,3(2H)-dione
Smiles: Cc1ccc2c(c1)C(=O)N(C2=O)c1c(C)cccc1Cl

STK676825
Synonyms: 6-amino-2-benzyl-8-(naphthalen-1-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCN(C2)Cc1ccccc1)c1cccc2c1cccc2)(C#N)C#N

STK676826
Synonyms: N-{5-[(2-cyanoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide
Smiles: CC(=O)Nc1nnc(s1)SCCC#N

STK676827
Synonyms: 4-(1-octyl-1H-benzimidazol-2-yl)-1,2,5-oxadiazol-3-amine
Smiles: CCCCCCCCn1c(nc2c1cccc2)c1nonc1N

STK676828
Synonyms: N-(3,4-dimethylphenyl)-N'-(2-phenylethyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Smiles: Cc1ccc(cc1C)Nc1nc2nonc2nc1NCCc1ccccc1

STK676829
Synonyms: N,N'-bis[2-(diethylamino)ethyl][1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Smiles: CCN(CCNc1nc2nonc2nc1NCCN(CC)CC)CC

STK676830
Synonyms: (2E)-2-(4-hydroxy-3-nitrobenzylidene)-1-benzothiophen-3(2H)-one
Smiles: [O-][N+](=O)c1cc(ccc1O)/C=C\1/Sc2c(C1=O)cccc2

STK676831
Synonyms: {2-bromo-4-[(Z)-(7,8-dimethyl-3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-6-ethoxyphenoxy}aceticacid
Smiles: CCOc1cc(cc(c1OCC(=O)O)Br)/C=c/1\sc2n(c1=O)c1c(n2)c(C)c(cc1)C

STK676832
Synonyms: 5-chloro-2-{5-[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]furan-2-yl}benzoicacid
Smiles: O=C1NC(=O)C(=Cc2ccc(o2)c2ccc(cc2C(=O)O)Cl)C(=O)N1

STK676833
Synonyms: 4-{[(1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindol-5-yl)carbonyl]amino}benzoicacid
Smiles: O=C(c1ccc2c(c1)C(=O)N(C2=O)c1ccccc1)Nc1ccc(cc1)C(=O)O

STK676834
Synonyms: 3-({[2-(3-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)benzoicacid
Smiles: Cc1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)Nc1cccc(c1)C(=O)O

STK676835
Synonyms: 2-(2-methoxyphenyl)-5-(2-nitrophenyl)-1H-isoindole-1,3(2H)-dione
Smiles: COc1ccccc1N1C(=O)c2c(C1=O)cc(cc2)c1ccccc1[N+](=O)[O-]

STK676836
Synonyms: ethyl(2E)-2-(3-bromo-4-hydroxy-5-methoxybenzylidene)-7-(4-hydroxy-3-methoxyphenyl)-5-methyl-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)n2c(=NC1c1ccc(c(c1)OC)O)s/c(=C/c1cc(Br)c(c(c1)OC)O)/c2=O

STK676839
Synonyms: 6-[(6,7-dimethoxy-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)amino]hexanoicacid
Smiles: COc1cc2c(cc1OC)CC(N=C2NCCCCCC(=O)O)(C)C

STK676840
Synonyms: 3-[({2-[4-(ethoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}carbonyl)amino]benzoicacid
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)C(=O)Nc1cccc(c1)C(=O)O

STK676841
Synonyms: dimethyl5-(4-amino-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(cc(c1)N1C(=O)c2c(C1=O)c(N)ccc2)C(=O)OC

STK676842
Synonyms: 4-acetyl-5-[4-(dimethylamino)phenyl]-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)N(C)C)CCN1CCOCC1

STK676843
Synonyms: N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-methylpyridine-4-carboxamide
Smiles: CN(C(=O)c1ccncc1)C1CC(C)(C)N(C(C1)(C)C)O

STK676844
Synonyms: 3-benzyl-3-hydroxy-2-(pyridin-3-ylmethyl)-2,3-dihydro-1H-isoindol-1-one
Smiles: O=C1c2ccccc2C(N1Cc1cccnc1)(O)Cc1ccccc1

STK676845
Synonyms: 6-{2-(3,4-dimethoxyphenyl)-4-hydroxy-3-[(4-methylphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}hexanoicacid
Smiles: COc1cc(ccc1OC)C1N(CCCCCC(=O)O)C(=O)C(=C1C(=O)c1ccc(cc1)C)O

STK676846
Synonyms: 6-{2-(4-fluorophenyl)-4-hydroxy-3-[(4-methoxyphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}hexanoicacid
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)F)CCCCCC(=O)O

STK676847
Synonyms: 3-nitro-4-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]benzoicacid
Smiles: [O-][N+](=O)c1cc(ccc1Sc1nnnn1c1ccccc1)C(=O)O

STK676848
Synonyms: 4-[(5E)-5-(1H-indol-3-ylmethylidene)-2,4,6-trioxotetrahydropyrimidin-1(2H)-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2c[nH]c3c2cccc3)/C1=O

STK676849
Synonyms: N-[1-(4-bromophenyl)ethyl]-2-chloroacetamide
Smiles: ClCC(=O)NC(c1ccc(cc1)Br)C

STK676851
Synonyms: ethyl1-(phenylsulfonyl)prolinate
Smiles: CCOC(=O)C1CCCN1S(=O)(=O)c1ccccc1

STK676852
Synonyms: 5-bromobenzene-1,2,4-tricarboxylicacid
Smiles: OC(=O)c1cc(C(=O)O)c(cc1C(=O)O)Br

STK676853
Synonyms: 2,2'-(ethane-1,2-diyldisulfanediyl)bis(2-phenoxyethanesulfonylfluoride)
Smiles: FS(=O)(=O)CC(Oc1ccccc1)SCCSC(CS(=O)(=O)F)Oc1ccccc1

STK676854
Synonyms: 1-[(4-methylphenyl)sulfonyl]-1,3a,4,4a,7,7a,8,8a-octahydro-4,8-methanoindeno[5,6-d][1,2,3]triazole
Smiles: Cc1ccc(cc1)S(=O)(=O)N1N=NC2C1C1CC2C2C1CC=C2

STK676855
Synonyms: [3'-(4-bromophenyl)-3,3-bis(4-chlorophenyl)-3H,3'H-spiro[2-benzothiophene-1,2'-[1,3,4]thiadiazol]-5'-yl](phenyl)methanone
Smiles: Brc1ccc(cc1)N1N=C(SC21SC(c1c2cccc1)(c1ccc(cc1)Cl)c1ccc(cc1)Cl)C(=O)c1ccccc1

STK676856
Synonyms: N-(furan-2-ylmethyl)-5-[(phenylsulfonyl)amino]pentanamide
Smiles: O=C(NCc1ccco1)CCCCNS(=O)(=O)c1ccccc1

STK676858
Synonyms: (2E)-N-[2-(biphenyl-2-yloxy)ethyl]-3-(furan-2-yl)prop-2-enamide
Smiles: O=C(/C=C/c1ccco1)NCCOc1ccccc1c1ccccc1

STK676859
Synonyms: N-[3-({[4-(acetylamino)phenyl]sulfonyl}amino)phenyl]-2-chloro-4,5-difluorobenzamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)NC(=O)c1cc(F)c(cc1Cl)F

STK676861
Synonyms: 5-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-4-hydroxy-4,5-dimethyl-3-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3-oxazolidin-2-one
Smiles: C/C(=C\CCC1(C)OC(=O)N(C1(C)O)C1CC(C)(C)NC(C1)(C)C)/CCC=C(C)C

STK676863
Synonyms: 3-{2-(1,3-benzodioxol-5-yl)-4-hydroxy-3-[(4-methylphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}propanoicacid
Smiles: OC(=O)CCN1C(=O)C(=C(C1c1ccc2c(c1)OCO2)C(=O)c1ccc(cc1)C)O

STK676864
Synonyms: 3-hydroxy-4-[(4-methylphenyl)carbonyl]-5-(2-nitrophenyl)-1-(pyridin-3-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1[N+](=O)[O-])Cc1cccnc1

STK676865
Synonyms: 4-acetyl-5-(4-chlorophenyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C1N(CCN2CCOCC2)C(=O)C(=C1C(=O)C)O

STK676866
Synonyms: 4-acetyl-5-(2-fluorophenyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccccc1F)CCN1CCOCC1

STK676868
Synonyms: N-benzyl-N-[1-(phenylcarbamoyl)cyclohexyl]-4-(1H-tetrazol-1-yl)benzamide
Smiles: O=C(C1(CCCCC1)N(C(=O)c1ccc(cc1)n1cnnn1)Cc1ccccc1)Nc1ccccc1

STK676869
Synonyms: 2-(3'-benzyl-2,4'-dioxo-3',4'-dihydro-1'H-spiro[indole-3,2'-quinazolin]-1(2H)-yl)-N,N-diethylacetamide
Smiles: CCN(C(=O)CN1c2ccccc2C2(C1=O)Nc1ccccc1C(=O)N2Cc1ccccc1)CC

STK676871
Synonyms: N-[2-(benzyloxy)-5-(trifluoromethyl)phenyl]-2-hydroxybenzamide
Smiles: O=C(c1ccccc1O)Nc1cc(ccc1OCc1ccccc1)C(F)(F)F

STK676872
Synonyms: 1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxylicacid
Smiles: OC(=O)C1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

STK676873
Synonyms: N-[4-(morpholin-4-yl)-3-(trifluoromethyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide
Smiles: O=C(C1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F)Nc1ccc(c(c1)C(F)(F)F)N1CCOCC1

STK676874
Synonyms: (2Z)-3-{[(furan-2-ylmethyl)(hydroxymethyl)amino]methyl}-2-[(hydroxymethyl)imino]-1,3-thiazolidin-4-one
Smiles: OC/N=C/1\SCC(=O)N1CN(Cc1ccco1)CO

STK676875
Synonyms: 4-fluoro-N'-[(2E)-5,5,6,6,7,7,8,8,9,9,10,10,10-tridecafluoro-4-oxodec-2-en-2-yl]benzohydrazide
Smiles: C/C(=C\C(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)/NNC(=O)c1ccc(cc1)F

STK676876
Synonyms: (2Z)-N-heptyl-2-[(4-methoxyphenyl)imino]-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
Smiles: CCCCCCCNC(=O)C1CC(=O)N(/C(=N/c2ccc(cc2)OC)/S1)C

STK676877
Synonyms: 6-chloro-6',6'-dimethyl-4-phenyl-2'-(prop-2-en-1-ylsulfanyl)-3,4,5',6'-tetrahydro-1'H-spiro[chromene-2,4'-pyrimidin]-7-ol
Smiles: C=CCSC1=NC2(CC(N1)(C)C)Oc1cc(O)c(cc1C(C2)c1ccccc1)Cl

STK676878
Synonyms: ethyl(2Z)-2-[3-bromo-4-(2-methoxy-2-oxoethoxy)benzylidene]-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1ccc(c(c1)Br)OCC(=O)OC)/s2

STK676879
Synonyms: ethyl(2Z)-2-[3-bromo-5-ethoxy-4-(prop-2-yn-1-yloxy)benzylidene]-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: C#CCOc1c(Br)cc(cc1OCC)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)C(C)C)C(=O)OCC)C

STK676880
Synonyms: methyl(2Z)-2-(3-chloro-5-ethoxy-4-hydroxybenzylidene)-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOc1cc(cc(c1O)Cl)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)C(C)C)C(=O)OC)C

STK676881
Synonyms: ethyl(2Z)-2-{2-[(2-fluorobenzyl)oxy]benzylidene}-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1ccccc1OCc1ccccc1F)/s2

STK676882
Synonyms: ethyl(2Z)-2-{3,5-dichloro-4-[(2-cyanobenzyl)oxy]benzylidene}-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1cc(Cl)c(c(c1)Cl)OCc1ccccc1C#N)/s2

STK676883
Synonyms: ethyl(2Z)-2-{[1-(3,5-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1cc(n(c1C)c1cc(C)cc(c1)C)C)/s2

STK676884
Synonyms: 4-(3-{(Z)-[6-(methoxycarbonyl)-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoicacid
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1cc(n(c1C)c1ccc(cc1)C(=O)O)C)/s2

STK676885
Synonyms: 2-methyl-N-[3-(morpholin-4-ylcarbonothioyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzenecarbothioamide
Smiles: S=C(c1c(sc2c1CCCC2)NC(=S)c1ccccc1C)N1CCOCC1

STK676889
Synonyms: 6-{3-[(4-chlorophenyl)carbonyl]-2-(4-fluorophenyl)-4-[(3-methylphenyl)amino]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}hexanoicacid
Smiles: OC(=O)CCCCCN1C(=O)C(=C(C1c1ccc(cc1)F)C(=O)c1ccc(cc1)Cl)Nc1cccc(c1)C

STK676890
Synonyms: [3-acetyl-4-hydroxy-2-(3-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]aceticacid
Smiles: COc1cccc(c1)C1N(CC(=O)O)C(=O)C(=C1C(=O)C)O

STK676895
Synonyms: ethylN-acetyl-N-(2,2-dicyanoethenyl)glycinate
Smiles: CCOC(=O)CN(C(=O)C)C=C(C#N)C#N

STK676897
Synonyms: (2E)-3-(4-hydroxy-3-nitrophenyl)-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(c(c1)[N+](=O)[O-])O)/c1nc2c([nH]1)ccc(c2)C

STK676898
Synonyms: 8-[(4-fluorobenzyl)sulfanyl]-1,3-dimethyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(SCc2ccc(cc2)F)nc2c1c(=O)n(C)c(=O)n2C

STK676899
Synonyms: 2-[(1,3-dimethyl-7-octyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
Smiles: CCCCCCCCn1c(SCC(=O)N)nc2c1c(=O)n(C)c(=O)n2C

STK676900
Synonyms: 5,5'-[(4-nitrophenyl)methanediyl]bis(1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione)
Smiles: O=C1NC(=S)N(C(=O)C1C(C1C(=O)NC(=S)N(C1=O)c1ccccc1)c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK676901
Synonyms: 4,4'-(piperazine-1,4-diyldicarbonyl)bis[1-(4-ethoxyphenyl)pyrrolidin-2-one]
Smiles: CCOc1ccc(cc1)N1CC(CC1=O)C(=O)N1CCN(CC1)C(=O)C1CC(=O)N(C1)c1ccc(cc1)OCC

STK676902
Synonyms: 7-[2-oxo-2-(piperidin-1-yl)ethoxy]-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Smiles: O=C(N1CCCCC1)COc1ccc2c(c1)oc(=O)c1c2CCC1

STK676903
Synonyms: 4-{[(5-tert-butyl-2-methylfuran-3-yl)carbonyl]amino}benzoicacid
Smiles: O=C(c1cc(oc1C)C(C)(C)C)Nc1ccc(cc1)C(=O)O

STK676905
Synonyms: [(4-{[(5-tert-butyl-2-methylfuran-3-yl)carbonyl]amino}phenyl)amino](oxo)aceticacid
Smiles: OC(=O)C(=O)Nc1ccc(cc1)NC(=O)c1cc(oc1C)C(C)(C)C

STK676906
Synonyms: 17-aminoandrost-5-en-3-ol
Smiles: OC1CCC2(C(=CCC3C2CCC2(C3CCC2N)C)C1)C

STK676908
Synonyms: 4-[(8xi,9xi,14xi,17beta)-androstan-17-yloxy]-4-oxobutanoicacid
Smiles: O=C(O[C@H]1CCC2[C@]1(C)CCC1C2CCC2[C@]1(C)CCCC2)CCC(=O)O

STK676909
Synonyms: 24-oxo-20,24-epoxychol-5-en-3-ylacetate
Smiles: CC(=O)OC1CCC2(C(=CCC3C2CCC2(C3CCC2C2(C)CCC(=O)O2)C)C1)C

STK676910
Synonyms: bis(3-nitrophenyl)methanone
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])c1cccc(c1)[N+](=O)[O-]

STK676911
Synonyms: 2,5-dimethyl-1-(2-methylbut-3-yn-2-yl)piperidin-4-one
Smiles: C#CC(N1CC(C)C(=O)CC1C)(C)C

STK676912
Synonyms: 2,5-dimethyl-4-phenyl-1-propylpiperidin-4-ylacetate
Smiles: CCCN1CC(C)C(CC1C)(OC(=O)C)c1ccccc1

STK676913
Synonyms: ethyl4-{3-[(2,4-dichlorobenzyl)amino]-2,5-dioxopyrrolidin-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)NCc1ccc(cc1Cl)Cl

STK676914
Synonyms: N-(2-phenylethyl)-2-(2,4,6-trifluorophenyl)-1,3-thiazolidine-3-carbothioamide
Smiles: Fc1cc(F)c(c(c1)F)C1SCCN1C(=S)NCCc1ccccc1

STK676915
Synonyms: 2-chloro-5-[(4-chloro-2,5-dimethoxyphenyl)sulfamoyl]-N-(4-nitrophenyl)benzamide
Smiles: COc1cc(Cl)c(cc1NS(=O)(=O)c1ccc(c(c1)C(=O)Nc1ccc(cc1)[N+](=O)[O-])Cl)OC

STK676916
Synonyms: thiophen-2-ylmethyl2-methyl-5-(morpholin-4-ylsulfonyl)benzoate
Smiles: O=C(c1cc(ccc1C)S(=O)(=O)N1CCOCC1)OCc1cccs1

STK676918
Synonyms: 3,4-dimethoxy-N-[5-(thiophen-2-ylmethyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1nnc(s1)Cc1cccs1

STK676919
Synonyms: 3-(phenylsulfamoyl)-N-[2-(piperidin-1-ylcarbonyl)phenyl]benzamide
Smiles: O=C(c1cccc(c1)S(=O)(=O)Nc1ccccc1)Nc1ccccc1C(=O)N1CCCCC1

STK676920
Synonyms: 2-(4-bromophenyl)-2-oxoethyl3-({[4-(morpholin-4-ylsulfonyl)thiophen-2-yl]carbonyl}amino)benzoate
Smiles: Brc1ccc(cc1)C(=O)COC(=O)c1cccc(c1)NC(=O)c1scc(c1)S(=O)(=O)N1CCOCC1

STK676921
Synonyms: 6-oxo-3-[3-oxo-3-(propan-2-yloxy)propyl]piperidine-3-carboxylicacid
Smiles: CC(OC(=O)CCC1(CCC(=O)NC1)C(=O)O)C

STK676922
Synonyms: 5-(5-chloro-2-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1c1nnc(n1c1ccccc1)S)Cl

STK676923
Synonyms: 6'-amino-5-fluoro-2-oxo-3'-(propan-2-yl)-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cc(F)cc1)c(n[nH]2)C(C)C

STK676924
Synonyms: {(1Z)-1-[(4-chlorophenyl)sulfanyl]-3,3-dimethylbut-1-en-2-yl}[bis(4-methylphenyl)]phosphaneselenide
Smiles: Cc1ccc(cc1)P(=[SeH])(/C(=C\Sc1ccc(cc1)Cl)/C(C)(C)C)c1ccc(cc1)C

STK676925
Synonyms: 2-({(1Z)-2-[bis(4-methylphenyl)phosphoroselenoyl]-3,3-dimethylbut-1-en-1-yl}sulfanyl)-1H-benzimidazole
Smiles: Cc1ccc(cc1)P(=[SeH])(/C(=C\Sc1nc2c([nH]1)cccc2)/C(C)(C)C)c1ccc(cc1)C

STK676928
Synonyms: 2-[4-(diphenylmethyl)piperazin-1-yl]-N-(2-ethoxyphenyl)-5-nitrobenzamide
Smiles: CCOc1ccccc1NC(=O)c1cc(ccc1N1CCN(CC1)C(c1ccccc1)c1ccccc1)[N+](=O)[O-]

STK676931
Synonyms: (8xi,9xi,14xi,17E)-17-hydrazinylideneestra-1,3,5(10)-trien-3-ol
Smiles: N/N=C/1\CCC2[C@]1(C)CCC1C2CCc2c1ccc(c2)O

STK676932
Synonyms: 3,5-dinitro-4-(4-phenylpiperazin-1-yl)benzoicacid
Smiles: OC(=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])N1CCN(CC1)c1ccccc1

STK676933
Synonyms: N-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)glycine
Smiles: OC(=O)CN(c1nc2c(s1)cc(cc2)[N+](=O)[O-])C

STK676935
Synonyms: 1-[(2-methoxybenzyl)oxy]-2-nitro-4-(trifluoromethyl)benzene
Smiles: COc1ccccc1COc1ccc(cc1[N+](=O)[O-])C(F)(F)F

STK676940
Synonyms: N-(1,3-benzothiazol-2-yl)-5-oxo-1-[4-(propan-2-yl)benzyl]pyrrolidine-3-carboxamide
Smiles: O=C(C1CC(=O)N(C1)Cc1ccc(cc1)C(C)C)Nc1nc2c(s1)cccc2

STK676941
Synonyms: 6'-amino-3'-(4-methoxyphenyl)-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cccc1)c(n[nH]2)c1ccc(cc1)OC

STK676942
Synonyms: (1E)-3-hydroxy-3-[imino(3-nitrophenyl)methyl]-1-(3-nitrophenyl)triaz-1-ene
Smiles: ON(C(=N)c1cccc(c1)[N+](=O)[O-])/N=N/c1cccc(c1)[N+](=O)[O-]

STK676944
Synonyms: N-(2,2,2-trinitroethyl)-4-[(Z)-{4-[(2,2,2-trinitroethyl)amino]-1,2,5-oxadiazol-3-yl}-NNO-azoxy]-1,2,5-oxadiazol-3-amine
Smiles: [O-]/[N+](=N\c1nonc1NCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])/c1nonc1NCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

STK676945
Synonyms: 1'-{[5-(phenylethynyl)furan-2-yl]carbonyl}-1,4'-bipiperidine-4'-carboxamide
Smiles: O=C(c1ccc(o1)C#Cc1ccccc1)N1CCC(CC1)(N1CCCCC1)C(=O)N

STK676946
Synonyms: 1-(2-methylbenzyl)tricyclo[3.3.1.1~3,7~]decane
Smiles: Cc1ccccc1CC12CC3CC(C2)CC(C1)C3

STK676947
Synonyms: 3-(2-aminoethyl)tricyclo[3.3.1.1~3,7~]decane-1-carboxylicacid
Smiles: NCCC12CC3CC(C1)CC(C2)(C3)C(=O)O

STK676950
Synonyms: 4,5-dibromo-1-methyl-2-[(4-nitrophenyl)sulfanyl]-1H-imidazole
Smiles: Brc1c(Br)nc(n1C)Sc1ccc(cc1)[N+](=O)[O-]

STK676951
Synonyms: 2,4-dinitro-1-(propan-2-yloxy)benzene
Smiles: CC(Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C

STK676952
Synonyms: 3-amino-4,5-dimethyl-4-nitrocyclopent-2-ene-1,1,2-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C1(C#N)C#N)C)(C)[N+](=O)[O-]

STK676953
Synonyms: 3-amino-5-ethyl-4-methyl-4-nitrocyclopent-2-ene-1,1,2-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C1(C#N)C#N)CC)(C)[N+](=O)[O-]

STK676955
Synonyms: 2-{[4-(2-chlorophenyl)-3-cyano-6-hydroxy-5-(thiophen-2-ylcarbonyl)-6-(trifluoromethyl)-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)C)NC(C(C1c1ccccc1Cl)C(=O)c1cccs1)(O)C(F)(F)F

STK676958
Synonyms: ethyl5-(1H-indol-3-yl)-4-(4-methylphenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazole-3-carboxylate
Smiles: CCOC(=O)C1=NN(C(N1c1ccc(cc1)C)c1c[nH]c2c1cccc2)c1ccccc1

STK676959
Synonyms: 5-nitro-2-(4-{(E)-[(2Z)-(4-oxo-1,3-thiazolidin-2-ylidene)hydrazinylidene]methyl}phenoxy)benzonitrile
Smiles: N#Cc1cc(ccc1Oc1ccc(cc1)/C=N/N=C/1\SCC(=O)N1)[N+](=O)[O-]

STK676963
Synonyms: N-(2,4-difluorophenyl)-2,2-bis(trifluoromethyl)butanamide
Smiles: CCC(C(F)(F)F)(C(F)(F)F)C(=O)Nc1ccc(cc1F)F

STK676965
Synonyms: [3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-en-2-yl](furan-2-yl)methanone
Smiles: O=C(N1C2C=CC(C1(C(F)(F)F)C(F)(F)F)C2)c1ccco1

STK676966
Synonyms: 2-(ethylsulfanyl)-7,7-bis(trifluoromethyl)-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3,5]triazin-5-one
Smiles: CCSc1sc2=NC(NC(=O)n2n1)(C(F)(F)F)C(F)(F)F

STK676969
Synonyms: 4-[(4-chlorophenyl)carbonyl]-5-(3-fluorophenyl)-3-hydroxy-1-(2-hydroxyethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: OCCN1C(c2cccc(c2)F)C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK676970
Synonyms: 4-[(4-chlorophenyl)carbonyl]-3-hydroxy-1-(2-hydroxyethyl)-5-(3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: OCCN1C(=O)C(=C(C1c1cccc(c1)OC)C(=O)c1ccc(cc1)Cl)O

STK676971
Synonyms: 1,1-bis(4-methylphenyl)-2-{[(E)-phenylmethylidene]amino}ethanol
Smiles: Cc1ccc(cc1)C(c1ccc(cc1)C)(C/N=C/c1ccccc1)O

STK676972
Synonyms: 4-acetyl-5-(4-bromophenyl)-1-[3-(dimethylamino)propyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CN(CCCN1C(c2ccc(cc2)Br)C(=C(C1=O)O)C(=O)C)C

STK676974
Synonyms: 1-(4-fluorophenyl)-4,4-dimethyl-2-oxaspiro[5.5]undecane-3,5-dione
Smiles: Fc1ccc(cc1)C1OC(=O)C(C(=O)C21CCCCC2)(C)C

STK676975
Synonyms: 3-(4-ethoxyphenyl)-1-phenylbenzo[f]quinoline
Smiles: CCOc1ccc(cc1)c1nc2ccc3c(c2c(c1)c1ccccc1)cccc3

STK676979
Synonyms: benzene-1,2,3-triamine
Smiles: Nc1c(N)cccc1N

STK676980
Synonyms: benzene-1,2,4-triamine
Smiles: Nc1ccc(c(c1)N)N

STK676982
Synonyms: 7-(2-hydroxyethyl)-1,3-dimethyl-8-(phenylamino)-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(Nc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK676983
Synonyms: 8-(benzylamino)-7-(2-hydroxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(NCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK676984
Synonyms: [2,4-dichloro-5-(morpholin-4-ylsulfonyl)phenyl](morpholin-4-yl)methanone
Smiles: Clc1cc(Cl)c(cc1C(=O)N1CCOCC1)S(=O)(=O)N1CCOCC1

STK676985
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-4-methyl-1H-1,2,3-triazole-5-carboxylicacid
Smiles: OC(=O)c1c(C)nnn1c1nonc1N

STK676986
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzamide
Smiles: COc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])C(F)(F)F)C(=O)Nc1cc(ccc1Cl)C(F)(F)F

STK676987
Synonyms: 1-[(3,4-dichlorophenyl)sulfonyl]cyclopentanecarboxylicacid
Smiles: OC(=O)C1(CCCC1)S(=O)(=O)c1ccc(c(c1)Cl)Cl

STK676989
Synonyms: 2-[(4-ethoxyphenyl)amino]-2-oxoethyl4-(5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-1H-tetrazol-1-yl)benzoate
Smiles: CCOc1ccc(cc1)NC(=O)COC(=O)c1ccc(cc1)n1nnnc1SCC(=O)N1CCOCC1

STK676990
Synonyms: 1-(2,3-dihydro-1H-indol-1-yl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanone
Smiles: O=C(N1CCc2c1cccc2)CSc1nnc2c(n1)n(C)c1c2cccc1

STK676991
Synonyms: 2,5-dichloro-3,6-bis(4-methylpiperidin-1-yl)cyclohexa-2,5-diene-1,4-dione
Smiles: CC1CCN(CC1)C1=C(Cl)C(=O)C(=C(C1=O)Cl)N1CCC(CC1)C

STK676992
Synonyms: 4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenylthiophene-2-carboxylate
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)OC(=O)c1cccs1)c(C)n[nH]2

STK676993
Synonyms: N-{2-[(2-methoxy-5-nitrobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide
Smiles: COc1ccc(cc1CSc1sc2c(n1)ccc(c2)NC(=O)CSc1nnnn1c1ccccc1)[N+](=O)[O-]

STK676994
Synonyms: (3Z)-3-(acenaphthylen-1(2H)-ylidene)-5-(2,4-dimethylphenyl)furan-2(3H)-one
Smiles: Cc1ccc(c(c1)C)C1=C/C(=C/2\Cc3c4c2cccc4ccc3)/C(=O)O1

STK676995
Synonyms: 1,3-benzodioxol-5-yl4-methyl-3-[(4-methylpiperidin-1-yl)sulfonyl]benzoate
Smiles: CC1CCN(CC1)S(=O)(=O)c1cc(ccc1C)C(=O)Oc1ccc2c(c1)OCO2

STK676997
Synonyms: 6',7'-dimethoxy-N-(4H-1,2,4-triazol-4-yl)-4'H-spiro[cyclopentane-1,3'-isoquinolin]-1'-amine
Smiles: COc1cc2c(cc1OC)CC1(N=C2Nn2cnnc2)CCCC1

STK676998
Synonyms: chloro[2-methoxy-2-(2-nitrophenyl)ethyl]mercury
Smiles: Cl[Hg]CC(c1ccccc1[N+](=O)[O-])OC

STK676999
Synonyms: N-tert-butyl-4,6-bis[2-(trifluoromethyl)-1H-benzimidazol-1-yl]-1,3,5-triazin-2-amine
Smiles: CC(Nc1nc(nc(n1)n1c2ccccc2nc1C(F)(F)F)n1c2ccccc2nc1C(F)(F)F)(C)C

STK677000
Synonyms: 4-({3-[(3-nitrophenyl)sulfonyl]phenyl}sulfonyl)morpholine
Smiles: [O-][N+](=O)c1cccc(c1)S(=O)(=O)c1cccc(c1)S(=O)(=O)N1CCOCC1

STK677003
Synonyms: 2-{(E)-2-cyano-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]ethenyl}benzoicacid
Smiles: N#C/C(=C\c1ccccc1C(=O)O)/c1scc(n1)c1cc2ccccc2oc1=O

STK677007
Synonyms: 5-cyano-2-methyl-N-(2-methylphenyl)-6-{[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanyl}-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc3c(c2)cccc3)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1C)C

STK677012
Synonyms: 6-methyl-4-phenyl-2H-pyrido[1,2-a][1,3,5]triazine-2-thione
Smiles: S=c1nc2cccc(n2c(n1)c1ccccc1)C

STK677013
Synonyms: N,2,2,5,5-pentamethyl-2,5-dihydro-1H-pyrrole-3-carboxamide
Smiles: CNC(=O)C1=CC(NC1(C)C)(C)C

STK677014
Synonyms: 4-(dimethylamino)-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
Smiles: O=C(c1ccc(cc1)N(C)C)NC1CC(C)(C)NC(C1)(C)C

STK677015
Synonyms: N-(1,2,2,6,6-pentamethylpiperidin-4-yl)furan-2-carboxamide
Smiles: CN1C(C)(C)CC(CC1(C)C)NC(=O)c1ccco1

STK677017
Synonyms: 2-amino-2-[(octyloxy)methyl]propane-1,3-diol
Smiles: CCCCCCCCOCC(CO)(CO)N

STK677018
Synonyms: 5-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-N-(2-bromophenyl)-5-oxopentanamide
Smiles: O=C(N/N=C/c1ccc(cc1)Br)CCCC(=O)Nc1ccccc1Br

STK677022
Synonyms: 2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazolidine-4-carboxylicacid
Smiles: CCOc1ccc(cc1OC)C1SCC(N1)C(=O)O

STK677023
Synonyms: 2-(3-iodophenyl)-1,3-thiazolidine-4-carboxylicacid
Smiles: OC(=O)C1CSC(N1)c1cccc(c1)I

STK677024
Synonyms: 4-hydroxy-4,5,5-trimethyl-3-(tetrahydrofuran-2-ylmethyl)-1,3-oxazolidin-2-one
Smiles: O=C1OC(C(N1CC1CCCO1)(C)O)(C)C

STK677025
Synonyms: 6,7-dimethoxy-1-(propan-2-yl)-3,4-dihydroisoquinoline
Smiles: COc1cc2c(cc1OC)CCN=C2C(C)C

STK677026
Synonyms: 6,7-dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline
Smiles: COc1cc2C(=NCCc2cc1OC)CC(C)C

STK677027
Synonyms: [6-(3-hydroxyphenyl)-4-methyl-1,5,2-dioxazinan-2-yl](phenyl)methanone
Smiles: CC1OC(ON(C1)C(=O)c1ccccc1)c1cccc(c1)O

STK677028
Synonyms: 2-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]-1,3-thiazolidine-4-carboxylicacid
Smiles: CCOc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C1SCC(N1)C(=O)O

STK677029
Synonyms: 2-{2-[(2,6-dichlorobenzyl)oxy]-5-nitrophenyl}-1,3-thiazolidine-4-carboxylicacid
Smiles: OC(=O)C1CSC(N1)c1cc(ccc1OCc1c(Cl)cccc1Cl)[N+](=O)[O-]

STK677030
Synonyms: N'-cyclohexylidene-2-hydroxy-2,2-bis(3-methylphenyl)acetohydrazide
Smiles: Cc1cccc(c1)C(c1cccc(c1)C)(C(=O)NN=C1CCCCC1)O

STK677031
Synonyms: [(2-methylphenyl)sulfanyl][bis(2,4,6-trimethylphenyl)]silane
Smiles: Cc1cc(C)c(c(c1)C)[SiH](c1c(C)cc(cc1C)C)Sc1ccccc1C

STK677033
Synonyms: 6-azido-N-[(2Z)-2-(hydroxyimino)-2-(4-methyl-1,2,5-oxadiazol-3-yl)ethyl]hexan-1-amine
Smiles: [N-]=[N+]=NCCCCCCNC/C(=N/O)/c1nonc1C

STK677034
Synonyms: (2-methyl-4-nitro-1H-imidazol-1-yl)acetonitrile
Smiles: [O-][N+](=O)c1cn(c(n1)C)CC#N

STK677035
Synonyms: 4-formyl-3,5-dimethyl-1H-pyrrole-2-carboxylicacid
Smiles: O=Cc1c(C)[nH]c(c1C)C(=O)O

STK677036
Synonyms: 3-amino-6H-indeno[1,2-e][1,2,4]triazolo[4,3-b][1,2,4]triazin-6-one
Smiles: O=C1c2nn3c(N)nnc3nc2c2c1cccc2

STK677037
Synonyms: 1-[(4-methylphenyl)sulfonyl]-N'-[(E)-(2,4,6-trimethoxyphenyl)methylidene]piperidine-4-carbohydrazide
Smiles: COc1cc(OC)cc(c1/C=N/NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)OC

STK677038
Synonyms: dihydropyrimidine-2,4(1H,3H)-dione
Smiles: O=C1CCNC(=O)N1

STK677039
Synonyms: 6-bromo-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylicacid
Smiles: OC(=O)C1CCCc2c1[nH]c1c2cc(cc1)Br

STK677040
Synonyms: 5-[(4-chloro-3-nitrophenyl)carbonyl]-2-benzofuran-1,3-dione
Smiles: O=C(c1ccc(c(c1)[N+](=O)[O-])Cl)c1ccc2c(c1)C(=O)OC2=O

STK677041
Synonyms: 4-[1,3-dioxo-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-dihydro-2H-isoindol-2-yl]benzoicacid
Smiles: O=C1N(c2ccc(cc2)C(=O)O)C(=O)c2c1cc(cc2)C12CC3CC(C2)CC(C1)C3

STK677042
Synonyms: N-cyanoethanimidamide
Smiles: CC(=N)NC#N

STK677045
Synonyms: 2,1,3-benzoxadiazole-5-carbonylchloride1-oxide
Smiles: ClC(=O)c1ccc2c(c1)no[n+]2[O-]

STK677047
Synonyms: N-(4-azido-1,2,5-oxadiazol-3-yl)-2-chloroacetamide
Smiles: [N-]=[N+]=Nc1nonc1NC(=O)CCl

STK677048
Synonyms: 2-amino-4,5,6,7-tetrahydro-1-benzofuran-3-carbonitrile
Smiles: N#Cc1c(N)oc2c1CCCC2

STK677049
Synonyms: [3'-(4-methylphenyl)-3,3-diphenyl-3H,3'H-spiro[2-benzothiophene-1,2'-[1,3,4]thiadiazol]-5'-yl](phenyl)methanone
Smiles: Cc1ccc(cc1)N1N=C(SC21SC(c1c2cccc1)(c1ccccc1)c1ccccc1)C(=O)c1ccccc1

STK677050
Synonyms: 2-({2-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: O=C(N1CCN(CC1)c1nc2c(s1)cccc2)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3

STK677051
Synonyms: N'-[(3Z)-1-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-4-methylbenzohydrazide
Smiles: Cc1ccc(cc1)C(=O)N/N=C/1\C(=O)N(c2c1cccc2)CN1CCN(CC1)C(c1ccccc1)c1ccccc1

STK677054
Synonyms: (2E)-2-cyano-3-{2-[(4-methyl-2-oxido-1,2,5-oxadiazol-3-yl)methoxy]phenyl}prop-2-enamide
Smiles: N#C/C(=C\c1ccccc1OCc1c(C)no[n+]1[O-])/C(=O)N

STK677056
Synonyms: 2-[(4-chloro-3-nitrophenyl)carbamoyl]naphthalen-1-ylbenzoate
Smiles: O=C(c1ccc2c(c1OC(=O)c1ccccc1)cccc2)Nc1ccc(c(c1)[N+](=O)[O-])Cl

STK677057
Synonyms: (2E)-5-(3-methoxyphenyl)-7-methyl-3-oxo-N-phenyl-2-(pyridin-2-ylmethylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Smiles: COc1cccc(c1)C1C(=C(C)N=c2n1c(=O)/c(=C\c1ccccn1)/s2)C(=O)Nc1ccccc1

STK677058
Synonyms: 2-chloro-5-{5-[(Z)-(2-{6-[(2,3-dimethylphenyl)amino][1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazinylidene)methyl]furan-2-yl}benzoicacid
Smiles: OC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=N\Nc1nc2nonc2nc1Nc1cccc(c1C)C

STK677059
Synonyms: 4-fluoro-N-[4-(1-{2-[(3-fluoro-4-methylphenyl)amino]-2-oxoethyl}-1H-benzimidazol-2-yl)-1,2,5-oxadiazol-3-yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1nonc1c1nc2c(n1CC(=O)Nc1ccc(c(c1)F)C)cccc2

STK677060
Synonyms: 7-(2-chloro-4-fluorobenzyl)-1,3-dimethyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(c(c1)Cl)Cn1c(S)nc2c1c(=O)n(C)c(=O)n2C

STK677062
Synonyms: 5-chloro-2-{5-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]furan-2-yl}benzoicacid
Smiles: Clc1ccc(c(c1)C(=O)O)c1ccc(o1)C=C1C(=O)N(C)C(=O)N(C1=O)C

STK677063
Synonyms: 8-chloro-7-[2-(ethenyloxy)ethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: C=COCCn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C

STK677065
Synonyms: 3-(3-methoxy-4-propoxyphenyl)benzo[f]quinoline-1-carboxylicacid
Smiles: CCCOc1ccc(cc1OC)c1nc2ccc3c(c2c(c1)C(=O)O)cccc3

STK677066
Synonyms: ethyl{[1-(1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnnn1c1ccc2c(c1)OCO2

STK677068
Synonyms: 2-(2-chloro-4-fluorobenzyl)-5-(4-fluorophenyl)-2H-tetrazole
Smiles: Fc1ccc(cc1)c1nnn(n1)Cc1ccc(cc1Cl)F

STK677070
Synonyms: 3-acetyl-2-(2,4,6-trifluorophenyl)-1,3-thiazolidine-4-carboxylicacid
Smiles: CC(=O)N1C(CSC1c1c(F)cc(cc1F)F)C(=O)O

STK677071
Synonyms: 2-{(E)-[(2-methylphenyl)imino]methyl}-4-[(E)-naphthalen-1-yldiazenyl]phenol
Smiles: Oc1ccc(cc1/C=N/c1ccccc1C)/N=N/c1cccc2c1cccc2

STK677074
Synonyms: 3-amino-4-formyl-5-methyl-2-(2-oxo-2-phenylethyl)cyclopent-3-ene-1,1,2-tricarbonitrile
Smiles: O=CC1=C(N)C(C(C1C)(C#N)C#N)(C#N)CC(=O)c1ccccc1

STK677075
Synonyms: 3'-(3-chloro-4-methylphenyl)-1-[(4-methylpiperidin-1-yl)methyl]-4'H-spiro[indole-3,2'-[1,3]thiazolidine]-2,4'(1H)-dione
Smiles: CC1CCN(CC1)CN1c2ccccc2C2(C1=O)SCC(=O)N2c1ccc(c(c1)Cl)C

STK677077
Synonyms: 2-(2,7-dipropoxy-9H-fluoren-9-ylidene)hydrazinecarbothioamide
Smiles: CCCOc1ccc2c(c1)/C(=N/NC(=S)N)/c1c2ccc(c1)OCCC

STK677078
Synonyms: 5-tert-butyl-2-(morpholin-4-ylmethyl)furan-3-carboxylicacid
Smiles: OC(=O)c1cc(oc1CN1CCOCC1)C(C)(C)C

STK677079
Synonyms: propyl2-hydroxyquinoline-4-carboxylate
Smiles: CCCOC(=O)c1cc(O)nc2c1cccc2

STK677080
Synonyms: 3-{[(2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-yl)carbonyl]amino}benzoicacid
Smiles: O=C(c1c(C)oc2c1CCCC2)Nc1cccc(c1)C(=O)O

STK677082
Synonyms: 1-(3-amino-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridin-2-yl)ethanone
Smiles: CC(=O)c1sc2c(c1N)cc1c(n2)CCC1

STK677083
Synonyms: 2-chloro-9-methoxy-6H-dibenzo[c,e][1,2]thiazine5,5-dioxide
Smiles: COc1ccc2c(c1)c1cc(Cl)ccc1S(=O)(=O)N2

STK677085
Synonyms: 2-[(4-methyl-2-nitrophenyl)sulfonyl]-2H-naphtho[1,8-cd][1,2]thiazole1,1-dioxide
Smiles: Cc1ccc(c(c1)[N+](=O)[O-])S(=O)(=O)N1c2cccc3c2c(S1(=O)=O)ccc3

STK677086
Synonyms: 3-acetyl-4-methylpentane-1,1,2,2-tetracarbonitrile
Smiles: N#CC(C(C(C(=O)C)C(C)C)(C#N)C#N)C#N

STK677088
Synonyms: diethyl2-(4-methoxyphenyl)-4,6-dioxocyclohexane-1,3-dicarboxylate
Smiles: CCOC(=O)C1C(=O)CC(=O)C(C1c1ccc(cc1)OC)C(=O)OCC

STK677089
Synonyms: diethyl2-(furan-2-yl)-4,6-dioxocyclohexane-1,3-dicarboxylate
Smiles: CCOC(=O)C1C(=O)CC(=O)C(C1c1ccco1)C(=O)OCC

STK677091
Synonyms: 1-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl](benzyl)amino}-N-(2,6-dimethylphenyl)-4-methylcyclohexanecarboxamide
Smiles: CC1CCC(CC1)(C(=O)Nc1c(C)cccc1C)N(C(=O)CSc1nc2c(s1)cccc2)Cc1ccccc1

STK677092
Synonyms: 1-[ethyl(1H-indol-3-ylacetyl)amino]-N-(3-methylphenyl)cyclohexanecarboxamide
Smiles: CCN(C1(CCCCC1)C(=O)Nc1cccc(c1)C)C(=O)Cc1c[nH]c2c1cccc2

STK677094
Synonyms: 2-(3,4,4,5-tetramethyl-5,6-dihydro-4H-1,2,5-oxadiazin-6-yl)phenol
Smiles: CN1C(ON=C(C1(C)C)C)c1ccccc1O

STK677095
Synonyms: 1-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]-N,N-dimethylcyclohexanamine
Smiles: Clc1ccc(cc1)n1nnnc1C1(CCCCC1)N(C)C

STK677096
Synonyms: (4E)-4-[2-(2,4-dinitrophenyl)hydrazinylidene]-6-(4-methoxyphenyl)-3-(propan-2-yl)cyclohexane-1,1,2,2-tetracarbonitrile
Smiles: COc1ccc(cc1)C1C/C(=N\Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/C(C(C1(C#N)C#N)(C#N)C#N)C(C)C

STK677097
Synonyms: (1E)-1-(4-methoxyphenyl)-5-methylhex-1-en-3-one
Smiles: COc1ccc(cc1)/C=C/C(=O)CC(C)C

STK677098
Synonyms: diethyl2,4-diacetyl-3-(4-methoxyphenyl)pentanedioate
Smiles: CCOC(=O)C(C(C(C(=O)OCC)C(=O)C)c1ccc(cc1)OC)C(=O)C

STK677100
Synonyms: N-(2-{4-[(3,4-dimethoxyphenyl)carbonyl]piperazin-1-yl}ethyl)-N'-(4-ethylphenyl)ethanediamide
Smiles: CCc1ccc(cc1)NC(=O)C(=O)NCCN1CCN(CC1)C(=O)c1ccc(c(c1)OC)OC

STK677101
Synonyms: 3-{[(5-tert-butyl-2-methylfuran-3-yl)carbonyl]amino}benzoicacid
Smiles: OC(=O)c1cccc(c1)NC(=O)c1cc(oc1C)C(C)(C)C

STK677102
Synonyms: (2Z)-3-(3-{[(5-tert-butyl-2-methylfuran-3-yl)carbonyl]amino}phenyl)prop-2-enoicacid
Smiles: OC(=O)/C=C\c1cccc(c1)NC(=O)c1cc(oc1C)C(C)(C)C

STK677103
Synonyms: 2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-carboxylicacid
Smiles: OC(=O)c1c(C)oc2c1CCCC2

STK677105
Synonyms: 1-({4-[(E)-2-phenylethenyl]phenyl}sulfonyl)pyrrolidine
Smiles: O=S(=O)(c1ccc(cc1)/C=C/c1ccccc1)N1CCCC1

STK677106
Synonyms: dimethyl3,3'-(piperazine-1,4-diyldisulfonyl)bis(6-chlorobenzoate)
Smiles: COC(=O)c1cc(ccc1Cl)S(=O)(=O)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C(=O)OC)Cl

STK677108
Synonyms: (2Z)-3-(3-{[(2-methyl-5-phenylfuran-3-yl)carbonyl]amino}phenyl)prop-2-enoicacid
Smiles: OC(=O)/C=C\c1cccc(c1)NC(=O)c1cc(oc1C)c1ccccc1

STK677110
Synonyms: 3-benzyl-7-hydroxy[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: Oc1ncnc2c1sc(=S)n2Cc1ccccc1

STK677111
Synonyms: 3-ethyl-7-hydroxy[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCn1c(=S)sc2c1ncnc2O

STK677112
Synonyms: (5E)-5-(1-{[2-(diethylamino)ethyl]amino}propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCN(CCN/C(=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)OC)/CC)CC

STK677113
Synonyms: 4-[(4-benzylpiperidin-1-yl)methyl]-3-chlorobenzonitrile
Smiles: N#Cc1ccc(c(c1)Cl)CN1CCC(CC1)Cc1ccccc1

STK677114
Synonyms: ethyl4-{5-[(Z)-(5-cyano-2-hydroxy-4-methyl-6-oxopyridin-3(6H)-ylidene)methyl]furan-2-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C/1\C(=NC(=O)C(=C1C)C#N)O

STK677115
Synonyms: 2-{[2-({2-[(4-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]carbamoyl}benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CSc1sc2c(n1)ccc(c2)NC(=O)c1ccccc1C(=O)O

STK677116
Synonyms: 2-[4-(diethylamino)phenyl]-2,3-dihydroquinazolin-4(1H)-one
Smiles: CCN(c1ccc(cc1)C1NC(=O)c2c(N1)cccc2)CC

STK677117
Synonyms: 5-(4-bromophenyl)-4-[(4-chlorophenyl)carbonyl]-1-[2-(dimethylamino)ethyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CN(CCN1C(=O)C(=C(C1c1ccc(cc1)Br)C(=O)c1ccc(cc1)Cl)O)C

STK677118
Synonyms: 4-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Fc1ccccc1c1onc(n1)c1nonc1N

STK677119
Synonyms: 2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
Smiles: O=C(Nc1scc(n1)c1ccccc1)COc1nsnc1N1CCOCC1

STK677120
Synonyms: 2-({5-[(4-cyclohexylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)propanamide
Smiles: O=C(Nc1ccccc1)CSc1nc2c(s1)cc(cc2)NC(=O)C(Sc1nnc(n1c1ccccc1)COc1ccc(cc1)C1CCCCC1)C

STK677121
Synonyms: 4-acetyl-3-hydroxy-5-(4-hydroxyphenyl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Oc1ccc(cc1)C1N(CCN2CCOCC2)C(=O)C(=C1C(=O)C)O

STK677122
Synonyms: 5-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-2-(morpholin-4-yl)benzoicacid(non-preferredname)
Smiles: O=C1N(c2ccc(c(c2)C(=O)O)N2CCOCC2)C(=O)C2C1C1c3ccccc3C2c2c1cccc2

STK677123
Synonyms: dimethyl5-({[3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-4-(morpholin-4-yl)phenyl]sulfonyl}amino)benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(cc(c1)C(=O)OC)NS(=O)(=O)c1ccc(c(c1)N1C(=O)C2C(C1=O)C1CC2C=C1)N1CCOCC1

STK677125
Synonyms: 2-(3,4-dimethylphenyl)-2-oxoethyl4-(1H-tetrazol-1-yl)benzoate
Smiles: O=C(c1ccc(cc1)n1cnnn1)OCC(=O)c1ccc(c(c1)C)C

STK677126
Synonyms: 9-ethyl-8-[(4-methoxyphenyl)carbonyl]-4-methyl-2H-furo[2,3-h]chromen-2-one
Smiles: CCc1c(oc2c1c1oc(=O)cc(c1cc2)C)C(=O)c1ccc(cc1)OC

STK677128
Synonyms: 5-nitro-2-[(pyridin-3-ylmethyl)amino]benzoicacid
Smiles: OC(=O)c1cc(ccc1NCc1cccnc1)[N+](=O)[O-]

STK677129
Synonyms: 4-acetyl-5-(2,4-dichlorophenyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(c(c1)Cl)C1N(CCN2CCOCC2)C(=O)C(=C1C(=O)C)O

STK677130
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-4,6-dimethoxy-1,3,5-triazin-2-amine
Smiles: COc1nc(Nc2ccc(cc2)OC(Cl)(F)F)nc(n1)OC

STK677131
Synonyms: 4-methyl-9-[(3-nitrophenyl)amino]-2H-furo[2,3-h]chromen-2-one
Smiles: O=c1cc(C)c2c(o1)c1c(coc1cc2)Nc1cccc(c1)[N+](=O)[O-]

STK677133
Synonyms: 4-{3-hydroxy-2-oxo-4-(phenylcarbonyl)-5-[(E)-2-phenylethenyl]-2,5-dihydro-1H-pyrrol-1-yl}butanoicacid
Smiles: OC(=O)CCCN1C(=O)C(=C(C1/C=C/c1ccccc1)C(=O)c1ccccc1)O

STK677134
Synonyms: 4-acetyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1OC)C1N(CCN2CCOCC2)C(=O)C(=C1C(=O)C)O

STK677135
Synonyms: 4-acetyl-5-(3-fluorophenyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1cccc(c1)C1N(CCN2CCOCC2)C(=O)C(=C1C(=O)C)O

STK677136
Synonyms: 4-acetyl-5-(4-ethoxyphenyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc(cc1)C1N(CCN2CCOCC2)C(=O)C(=C1C(=O)C)O

STK677137
Synonyms: 3,5-dinitro-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}benzoicacid
Smiles: OC(=O)c1cc(cc(c1N1CCN(CC1)c1cccc(c1)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

STK677139
Synonyms: 4-{[(2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-yl)carbonyl]amino}butanoicacid
Smiles: OC(=O)CCCNC(=O)c1c(C)oc2c1CCCC2

STK677140
Synonyms: 4,5,6,7-tetranitro-1H-benzimidazol-2-amine
Smiles: Nc1nc2c([nH]1)c([N+](=O)[O-])c(c(c2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

STK677142
Synonyms: 4-{[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonyl]amino}benzoicacid
Smiles: Cc1ccc2c(c1S(=O)(=O)Nc1ccc(cc1)C(=O)O)nsn2

STK677145
Synonyms: 6,6'-[biphenyl-2,2'-diylbis(oxy)]bis(1H,3H-benzo[de]isochromene-1,3-dione)
Smiles: O=C1OC(=O)c2c3c1ccc(c3ccc2)Oc1ccccc1c1ccccc1Oc1ccc2c3c1cccc3C(=O)OC2=O

STK677146
Synonyms: 5-(5,6-dibromo-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-2-(morpholin-4-yl)benzoicacid
Smiles: BrC1C(Br)C2CC1C1C2C(=O)N(C1=O)c1ccc(c(c1)C(=O)O)N1CCOCC1

STK677149
Synonyms: 2-methyl-1-(2-phenylethyl)-6-(trifluoromethyl)-1H-benzimidazole
Smiles: Cc1nc2c(n1CCc1ccccc1)cc(cc2)C(F)(F)F

STK677151
Synonyms: N-(2,4-dimethylphenyl)-2-[2-methyl-5-(naphthalen-1-yl)-2,3-dihydro-1,3,4-thiadiazol-2-yl]acetamide
Smiles: O=C(CC1(C)NN=C(S1)c1cccc2c1cccc2)Nc1ccc(cc1C)C

STK677153
Synonyms: 1-{(Z)-[4-(dimethylamino)phenyl]diazenyl}-4-(piperidin-1-yl)anthracene-9,10-dione
Smiles: O=C1c2ccccc2C(=O)c2c1c(/N=N\c1ccc(cc1)N(C)C)ccc2N1CCCCC1

STK677154
Synonyms: 4-{[(2-imino-4-oxo-3-{[(1E)-1-(thiophen-2-yl)ethylidene]amino}-1,3-thiazinan-6-yl)carbonyl]amino}benzoicacid
Smiles: O=C(C1CC(=O)N(C(=N)S1)/N=C(/c1cccs1)\C)Nc1ccc(cc1)C(=O)O

STK677155
Synonyms: 5-methyl-2-(methylsulfanyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: CSc1nn2c(n1)NC(=CC2c1ccccc1)C

STK677157
Synonyms: ethyl5-(chloromethyl)-3-methyl-4-octadecanoyl-1H-pyrrole-2-carboxylate
Smiles: CCCCCCCCCCCCCCCCCC(=O)c1c(CCl)[nH]c(c1C)C(=O)OCC

STK677159
Synonyms: 4-chlorophenyl2-aminobenzoate
Smiles: Clc1ccc(cc1)OC(=O)c1ccccc1N

STK677160
Synonyms: methyl2-{[2-(acetylamino)-1,1,1,3,3,3-hexafluoropropan-2-yl]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCN(C2)C)NC(C(F)(F)F)(C(F)(F)F)NC(=O)C

STK677161
Synonyms: methyl2-{[1,1,1,3,3,3-hexafluoro-2-(propanoylamino)propan-2-yl]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCN(C2)C)NC(C(F)(F)F)(C(F)(F)F)NC(=O)CC

STK677162
Synonyms: methyl2-{[3-ethoxy-1,1,1-trifluoro-3-oxo-2-(propanoylamino)propan-2-yl]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C(=O)OC)CCN(C2)C)NC(=O)CC

STK677163
Synonyms: 7-methyl-4-phenyl-2H-pyrido[1,2-a][1,3,5]triazine-2-thione
Smiles: Cc1ccc2n(c1)c(nc(=S)n2)c1ccccc1

STK677164
Synonyms: 2-chloroethyl2-oxo-6-(piperidin-1-ylsulfonyl)-1,3-benzoxazole-3(2H)-carboxylate
Smiles: ClCCOC(=O)n1c(=O)oc2c1ccc(c2)S(=O)(=O)N1CCCCC1

STK677165
Synonyms: 6-(2-methoxyphenyl)-5,7-diphenyl-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
Smiles: COc1ccccc1C1C2=C(C(=O)N1c1ccccc1)NCCN=C2c1ccccc1

STK677166
Synonyms: 4-acetyl-5-(2,4-dimethoxyphenyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(OC)ccc1C1N(CCN2CCOCC2)C(=O)C(=C1C(=O)C)O

STK677167
Synonyms: N-[2-({2-[(4-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]-2-(morpholin-4-ylcarbonyl)benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CSc1sc2c(n1)ccc(c2)NC(=O)c1ccccc1C(=O)N1CCOCC1

STK677169
Synonyms: 2-({2-[(2-methoxy-5-nitrobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}amino)-2-oxoethyldiethylcarbamodithioate
Smiles: CCN(C(=S)SCC(=O)Nc1ccc2c(c1)sc(n2)SCc1cc(ccc1OC)[N+](=O)[O-])CC

STK677170
Synonyms: 1H-perimidine-2(3H)-thione
Smiles: S=c1[nH]c2cccc3c2c([nH]1)ccc3

STK677171
Synonyms: methyl4-[({[6-({[2-(pyrrolidin-1-ylcarbonyl)phenyl]carbonyl}amino)-1,3-benzothiazol-2-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nc2c(s1)cc(cc2)NC(=O)c1ccccc1C(=O)N1CCCC1

STK677172
Synonyms: 2-{2-[(2-methoxy-5-nitrobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}-5-nitro-1H-isoindole-1,3(2H)-dione
Smiles: COc1ccc(cc1CSc1sc2c(n1)ccc(c2)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-])[N+](=O)[O-]

STK677173
Synonyms: 2-{[6-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1sc2c(n1)ccc(c2)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-]

STK677174
Synonyms: methyl2-[({[6-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CSc1sc2c(n1)ccc(c2)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-]

STK677175
Synonyms: N-[2-(4-chlorophenoxy)ethyl]-2-{[6-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
Smiles: O=C(CSc1sc2c(n1)ccc(c2)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-])NCCOc1ccc(cc1)Cl

STK677176
Synonyms: N-(5-chloro-2-methylphenyl)-2-{[6-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1sc2c(n1)ccc(c2)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-]

STK677177
Synonyms: N-(2-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propanamide
Smiles: O=C(Nc1ccccc1)CSc1sc2c(n1)ccc(c2)NC(=O)C(Sc1nnnn1c1ccccc1)C

STK677178
Synonyms: 5-(1-{[5-(diethylamino)pentan-2-yl]amino}propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCN(CCCC(NC(=C1C(=O)NC(=O)NC1=O)CC)C)CC

STK677180
Synonyms: 2-ethoxy-4-(morpholin-4-yl)-6-(piperidin-1-yl)-1,3,5-triazine
Smiles: CCOc1nc(nc(n1)N1CCOCC1)N1CCCCC1

STK677181
Synonyms: N-[2-(4-chlorophenoxy)ethyl]-2-{[6-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
Smiles: O=C(CSc1nc2c(s1)cc(cc2)N1C(=O)C2C(C1=O)C1CC2C=C1)NCCOc1ccc(cc1)Cl

STK677182
Synonyms: methyl4-[({[6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nc2c(s1)cc(cc2)N1C(=O)c2c(C1=O)cccc2[N+](=O)[O-]

STK677183
Synonyms: 5-(4-bromophenyl)-5-methyl-2-phenyl-1,2,4-triazolidine-3-thione
Smiles: Brc1ccc(cc1)C1(C)NC(=S)N(N1)c1ccccc1

STK677184
Synonyms: 1-[5-fluoro-2-methyl-4-(4-methylpiperazin-1-yl)phenyl]ethanone
Smiles: CN1CCN(CC1)c1cc(C)c(cc1F)C(=O)C

STK677185
Synonyms: 1-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]propan-1-one
Smiles: CCC(=O)c1ccc(c(c1)F)N1CCN(CC1)C

STK677186
Synonyms: (4-fluorophenyl)[4-(4-methylpiperazin-1-yl)phenyl]methanone
Smiles: CN1CCN(CC1)c1ccc(cc1)C(=O)c1ccc(cc1)F

STK677187
Synonyms: 1-[4-fluoro-5-(4-methylpiperidin-1-yl)-2-nitrophenyl]piperazine
Smiles: CC1CCN(CC1)c1cc(N2CCNCC2)c(cc1F)[N+](=O)[O-]

STK677188
Synonyms: 5-[ethyl(phenyl)amino]pent-3-yn-1-ylacetate
Smiles: CCN(c1ccccc1)CC#CCCOC(=O)C

STK677189
Synonyms: 1-(2,2-dichloro-1-methylcyclopropyl)-4-(propan-2-yl)benzene
Smiles: CC(c1ccc(cc1)C1(C)CC1(Cl)Cl)C

STK677192
Synonyms: 2-{4-[(2-fluorobenzyl)oxy]phenyl}-1,3-thiazolidine-4-carboxylicacid
Smiles: OC(=O)C1CSC(N1)c1ccc(cc1)OCc1ccccc1F

STK677194
Synonyms: 3-acetyl-2-(trifluoromethyl)pyridin-4-ylacetate
Smiles: CC(=O)Oc1ccnc(c1C(=O)C)C(F)(F)F

STK677195
Synonyms: 1-[1-(3-chlorophenyl)-4-(thiophen-2-ylcarbonyl)-1H-pyrazol-3-yl]ethanone
Smiles: Clc1cccc(c1)n1nc(c(c1)C(=O)c1cccs1)C(=O)C

STK677198
Synonyms: 3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-one
Smiles: O=C1CCN(CC1C)Cc1ccccn1

STK677199
Synonyms: ethyl(2E,4E)-3,7,11-trimethyldodeca-2,4-dienoate
Smiles: CCOC(=O)/C=C(/C=C/CC(CCCC(C)C)C)\C

STK677200
Synonyms: propan-2-yl(2E,4E)-11-methoxy-3,7,11-trimethyldodeca-2,4-dienoate
Smiles: COC(CCCC(C/C=C/C(=C/C(=O)OC(C)C)/C)C)(C)C

STK677201
Synonyms: ethyl(2E,4E)-3-methyldeca-2,4-dienoate
Smiles: CCCCC/C=C/C(=C/C(=O)OCC)/C

STK677206
Synonyms: 4-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: COc1cc(cc(c1OC)OC)c1onc(n1)c1nonc1N

STK677209
Synonyms: 4-acetyl-1-[3-(dimethylamino)propyl]-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1N(CCCN(C)C)C(=O)C(=C1C(=O)C)O

STK677212
Synonyms: methylN-(2-methoxyphenyl)glycinate
Smiles: COC(=O)CNc1ccccc1OC

STK677215
Synonyms: 4-[5-(2,6-difluorophenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Fc1cccc(c1c1onc(n1)c1nonc1N)F

STK677216
Synonyms: 4-[5-(4-iodo-1-methyl-1H-pyrazol-3-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Cn1cc(c(n1)c1onc(n1)c1nonc1N)I

STK677219
Synonyms: 6-nitro-2-phenyl-1,2-benzothiazol-3(2H)-one1,1-dioxide
Smiles: O=C1c2ccc(cc2S(=O)(=O)N1c1ccccc1)[N+](=O)[O-]

STK677220
Synonyms: 4,6-diazido-2-phenyl-1,2-benzothiazol-3(2H)-one1-oxide
Smiles: [N-]=[N+]=Nc1cc(N=[N+]=[N-])cc2c1c(=O)n(s2=O)c1ccccc1

STK677222
Synonyms: 6-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-5-cyano-4-(3-fluorophenyl)-2-methyl-N-(2-methylphenyl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)Br)NC(=C(C1c1cccc(c1)F)C(=O)Nc1ccccc1C)C

STK677223
Synonyms: methyl9-cyano-6-oxo-8-(thiophen-2-yl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3]thiazine-7-carboxylate
Smiles: COC(=O)C1C(c2cccs2)C(=C2N(C1=O)CCCS2)C#N

STK677224
Synonyms: 2-{[3-(ethoxycarbonyl)-6-methoxyquinolin-4-yl]amino}benzoicacid
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccccc1C(=O)O)cc(cc2)OC

STK677225
Synonyms: 4-chloro-N-(4-fluorophenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-amine
Smiles: COc1ccc(cc1)N1CCN(CC1)c1nc(Cl)nc(n1)Nc1ccc(cc1)F

STK677227
Synonyms: 2-oxo-2-(thiophen-2-yl)ethyl4-bromo-3-(morpholin-4-ylsulfonyl)benzoate
Smiles: O=C(c1ccc(c(c1)S(=O)(=O)N1CCOCC1)Br)OCC(=O)c1cccs1

STK677228
Synonyms: 2,5-dichloro-3,6-bis(4-ethylpiperazin-1-yl)cyclohexa-2,5-diene-1,4-dione
Smiles: CCN1CCN(CC1)C1=C(Cl)C(=O)C(=C(C1=O)Cl)N1CCN(CC1)CC

STK677229
Synonyms: 2-{[3-(ethoxycarbonyl)-6-(trifluoromethoxy)quinolin-4-yl]amino}benzoicacid
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccccc1C(=O)O)cc(cc2)OC(F)(F)F

STK677231
Synonyms: 2-sulfanyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]quinazolin-4(3H)-one
Smiles: Sc1nnc(o1)c1ccc(cc1)n1c(S)nc2c(c1=O)cccc2

STK677232
Synonyms: 4-({[5-(4-isothiocyanatophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)pyridine
Smiles: S=C=Nc1ccc(cc1)c1nnc(o1)SCc1ccncc1

STK677233
Synonyms: 2-phenyl-5-{[(2-phenyl-1,3-dioxolan-2-yl)methyl]sulfanyl}-1,3,4-oxadiazole
Smiles: c1ccc(cc1)c1nnc(o1)SCC1(OCCO1)c1ccccc1

STK677234
Synonyms: 4-(4-amino-3,5-dichlorophenyl)-5-phenyl-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1c1cc(Cl)c(c(c1)Cl)N)c1ccccc1

STK677236
Synonyms: 4-(2,4-dichlorophenyl)-5-(1H-1,2,4-triazol-1-yl)-1,3-thiazol-2-amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(sc1n1cncn1)N

STK677237
Synonyms: 2,6-dibromo-4-formylphenylmorpholine-4-carboxylate
Smiles: O=Cc1cc(Br)c(c(c1)Br)OC(=O)N1CCOCC1

STK677238
Synonyms: N-(3-oxo-1,3-dihydro-2-benzofuran-5-yl)pyridine-4-carboxamide
Smiles: O=C(c1ccncc1)Nc1ccc2c(c1)C(=O)OC2

STK677242
Synonyms: 2-formyl-4-[(E)-phenyldiazenyl]phenylmorpholine-4-carboxylate
Smiles: O=Cc1cc(/N=N/c2ccccc2)ccc1OC(=O)N1CCOCC1

STK677243
Synonyms: 2-chloro-4-formyl-6-methoxyphenylmorpholine-4-carboxylate
Smiles: O=Cc1cc(Cl)c(c(c1)OC)OC(=O)N1CCOCC1

STK677244
Synonyms: 6-tert-butyl-2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)Nc1sc2c(c1C(=O)Nc1ccccc1C(F)(F)F)CCC(C2)C(C)(C)C

STK677246
Synonyms: morpholin-4-yl(2-{[(Z)-morpholin-4-yl(phenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanethione
Smiles: S=C(c1c(sc2c1CCCC2)/N=C(/c1ccccc1)\N1CCOCC1)N1CCOCC1

STK677247
Synonyms: nonyl3-amino-6-methyl-5-(phenylcarbamoyl)-4-(pyridin-3-yl)thieno[2,3-b]pyridine-2-carboxylate
Smiles: CCCCCCCCCOC(=O)c1sc2c(c1N)c(c1cccnc1)c(c(n2)C)C(=O)Nc1ccccc1

STK677249
Synonyms: N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(morpholin-4-ylcarbonyl)benzamide
Smiles: O=C(N1CCc2c1cccc2)CSc1nc2c(s1)cc(cc2)NC(=O)c1ccccc1C(=O)N1CCOCC1

STK677250
Synonyms: 3,6-dimethyl-1-[3-(pyrrolidin-1-yl)propyl]pyrimidine-2,4(1H,3H)-dione
Smiles: Cc1cc(=O)n(c(=O)n1CCCN1CCCC1)C

STK677251
Synonyms: 3,6-dimethyl-1-[4-(pyrrolidin-1-yl)butyl]pyrimidine-2,4(1H,3H)-dione
Smiles: Cn1c(=O)cc(n(c1=O)CCCCN1CCCC1)C

STK677252
Synonyms: 11-methyldibenzo[b,f][1,4]thiazepine
Smiles: CC1=Nc2ccccc2Sc2c1cccc2

STK677254
Synonyms: 1-(4-hydroxyphenyl)-3-[(4-methylphenyl)amino]-4-(methylsulfonyl)-5-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)NC1=C(C(N(C1=O)c1ccc(cc1)O)c1ccccc1)S(=O)(=O)C

STK677255
Synonyms: 5-(3,4-dimethoxyphenyl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-[(4-methylphenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1OC)C1N(CCCn2cncc2)C(=O)C(=C1C(=O)c1ccc(cc1)C)O

STK677256
Synonyms: 6-[3-(2,2-dimethylpropanoyl)-4-hydroxy-5-oxo-2-phenyl-2,5-dihydro-1H-pyrrol-1-yl]hexanoicacid
Smiles: OC(=O)CCCCCN1C(c2ccccc2)C(=C(C1=O)O)C(=O)C(C)(C)C

STK677257
Synonyms: 6-methyl-N-{4-[2-(morpholin-4-yl)-2-oxoethoxy]phenyl}-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
Smiles: O=c1[nH]c(C)c(c(=O)[nH]1)S(=O)(=O)Nc1ccc(cc1)OCC(=O)N1CCOCC1

STK677259
Synonyms: 5,7-dimethyl-N-(2-phenoxyethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide
Smiles: Cc1cc(C)n2c(n1)nc(n2)S(=O)(=O)NCCOc1ccccc1

STK677261
Synonyms: [4-(phenoxymethyl)-6-(pyridin-3-yl)-1,5,2-dioxazinan-2-yl](phenyl)methanone
Smiles: O=C(N1CC(COc2ccccc2)OC(O1)c1cccnc1)c1ccccc1

STK677263
Synonyms: methyl4-({[1-(3,4-dichlorophenyl)-5-oxo-3-(2-phenylethyl)-2-thioxoimidazolidin-4-yl]acetyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CC1N(CCc2ccccc2)C(=S)N(C1=O)c1ccc(c(c1)Cl)Cl

STK677264
Synonyms: 8-[2-(4-methoxyphenyl)ethyl]-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1)CCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccccc1

STK677265
Synonyms: 8-[2-(2-methoxyphenyl)ethyl]-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccccc1CCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccccc1

STK677270
Synonyms: 2-[4-(4,5-diphenyl-1H-imidazol-2-yl)-2,6-dimethoxyphenoxy]-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: COc1cc(cc(c1OCC(=O)Nc1ccc(cc1)OC(F)(F)F)OC)c1nc(c([nH]1)c1ccccc1)c1ccccc1

STK677271
Synonyms: 4-methoxy-N-phenyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
Smiles: COc1nc(Nc2ccccc2)nc(n1)OCC(F)(F)F

STK677272
Synonyms: 4-[6-amino-5-cyano-3-(2,4-dichlorophenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-bromo-6-ethoxyphenylthiophene-2-carboxylate
Smiles: CCOc1cc(cc(c1OC(=O)c1cccs1)Br)C1C(=C(N)Oc2c1c(n[nH]2)c1ccc(cc1Cl)Cl)C#N

STK677275
Synonyms: 2-{[6-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nc2c(s1)cc(cc2)N1C(=O)C2C(C1=O)C1CC2C=C1

STK677277
Synonyms: 2-[2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CCc2cn3c(n2)scc3C)C(=O)c2c1cccc2

STK677278
Synonyms: 4-acetyl-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1O)C1N(CCN2CCOCC2)C(=O)C(=C1C(=O)C)O

STK677279
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-4-methylphthalazin-1-amine
Smiles: Cc1nnc(c2c1cccc2)Nc1ccc(cc1)OC(Cl)(F)F

STK677281
Synonyms: 6-(chloromethyl)-4-(methoxymethyl)-2-methylpyrido[3'',2'':4',5']thieno[3',2':4,5]pyrimido[1,6-a]benzimidazole
Smiles: COCc1cc(C)nc2c1c1nc(CCl)n3c(c1s2)nc1c3cccc1

STK677282
Synonyms: 2,4,6-trimethylpyrido[3'',2'':4',5']thieno[3',2':4,5]pyrimido[1,6-a]benzimidazole
Smiles: Cc1cc(C)c2c(n1)sc1c2nc(n2c1nc1c2cccc1)C

STK677285
Synonyms: 5-{[ethyl(dimethyl)silyl]methyl}-6-hydroxy-2-[(2-oxo-2-phenylethyl)sulfanyl]pyrimidin-4(3H)-one
Smiles: CC[Si](Cc1c(O)nc([nH]c1=O)SCC(=O)c1ccccc1)(C)C

STK677286
Synonyms: (3,4-difluorophenyl)(1H-1,2,4-triazol-1-yl)methanone
Smiles: Fc1ccc(cc1F)C(=O)n1cncn1

STK677287
Synonyms: (1Z)-1-(2-hydroxy-5-nitrobenzylidene)-6-methylfuro[3,4-c]pyridine-3,4(1H,5H)-dione
Smiles: Oc1ccc(cc1/C=C/1\OC(=O)c2c1cc(C)[nH]c2=O)[N+](=O)[O-]

STK677290
Synonyms: 2,6-dichloro-4-methylpyridine-3-sulfonamide
Smiles: Clc1cc(C)c(c(n1)Cl)S(=O)(=O)N

STK677291
Synonyms: 2,5-dichloro-N,N,4,6-tetramethylpyridine-3-carboxamide
Smiles: CN(C(=O)c1c(Cl)nc(c(c1C)Cl)C)C

STK677292
Synonyms: 2,5,6-trichloro-4-methylpyridine-3-carboxamide
Smiles: NC(=O)c1c(Cl)nc(c(c1C)Cl)Cl

STK677293
Synonyms: N-(4-methoxyphenyl)-3,5-dinitro-2-[(E)-(2-phenylhydrazinylidene)methyl]aniline
Smiles: COc1ccc(cc1)Nc1cc(cc(c1/C=N/Nc1ccccc1)[N+](=O)[O-])[N+](=O)[O-]

STK677294
Synonyms: 1,3-dinitro-7-(trifluoromethoxy)acridine
Smiles: [O-][N+](=O)c1cc(cc2c1cc1cc(ccc1n2)OC(F)(F)F)[N+](=O)[O-]

STK677295
Synonyms: N,N'-ethane-1,2-diyldiformamide
Smiles: O=CNCCNC=O

STK677298
Synonyms: 4-hydroxy-4,5,5-trimethyl-3-[2-(2-methyl-5-nitro-1H-indol-3-yl)ethyl]-1,3-oxazolidin-2-one
Smiles: O=C1OC(C(N1CCc1c(C)[nH]c2c1cc(cc2)[N+](=O)[O-])(C)O)(C)C

STK677299
Synonyms: 3-[2-(1,2-dimethyl-1H-indol-3-yl)ethyl]-4-hydroxy-4,7,7,9,9-pentamethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Smiles: O=C1OC2(C(N1CCc1c(C)n(c3c1cccc3)C)(C)O)CC(C)(C)NC(C2)(C)C

STK677300
Synonyms: 2,2'-(4-methyl-5-nitrobenzene-1,3-diyl)bis(1H-isoindole-1,3(2H)-dione)
Smiles: O=C1N(c2cc([N+](=O)[O-])c(c(c2)N2C(=O)c3c(C2=O)cccc3)C)C(=O)c2c1cccc2

STK677301
Synonyms: 6-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccccc1C1C(=C(SCC(=O)Nc2cccc(c2C)Cl)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK677318
Synonyms: N-[(1Z)-3-(2-chlorophenyl)-1-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-2-cyano-5-oxo-5-phenylpent-1-en-1-yl]benzamide
Smiles: N#C/C(=C(/NC(=O)c1ccccc1)\SCC(=O)Nc1ccc(cc1)Cl)/C(c1ccccc1Cl)CC(=O)c1ccccc1

STK677319
Synonyms: N-[(1Z)-1-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-3-(2-chlorophenyl)-2-cyano-5-oxo-5-phenylpent-1-en-1-yl]benzamide
Smiles: N#C/C(=C(/NC(=O)c1ccccc1)\SCC(=O)Nc1cccc(c1C)Cl)/C(c1ccccc1Cl)CC(=O)c1ccccc1

STK677320
Synonyms: methyl({3-cyano-4-(furan-2-yl)-6-methyl-5-[(2-methylphenyl)carbamoyl]-1,4-dihydropyridin-2-yl}sulfanyl)acetate
Smiles: COC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1C)c1ccco1

STK677321
Synonyms: N-(4-chlorophenyl)-5-cyano-2-methyl-6-(prop-2-en-1-ylsulfanyl)-1,4-dihydro-4,4'-bipyridine-3-carboxamide
Smiles: C=CCSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccc(cc1)Cl)c1ccncc1

STK677324
Synonyms: 4-formyl-2,6-dimethoxyphenylmethanesulfonate
Smiles: COc1cc(C=O)cc(c1OS(=O)(=O)C)OC

STK677325
Synonyms: 4,6-dimethoxy-N,N-diphenyl-1,3,5-triazin-2-amine
Smiles: COc1nc(nc(n1)OC)N(c1ccccc1)c1ccccc1

STK677326
Synonyms: 2,4-bis[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine
Smiles: CN1CCN(CC1)c1nc(OC(C(F)(F)F)C(F)(F)F)nc(n1)OC(C(F)(F)F)C(F)(F)F

STK677327
Synonyms: 2-{[2-(2-fluorophenoxy)ethyl]sulfanyl}-6-phenylpyrimidin-4-ol
Smiles: Oc1nc(SCCOc2ccccc2F)nc(c1)c1ccccc1

STK677328
Synonyms: 2-[(4-hydroxy-6-propylpyrimidin-2-yl)sulfanyl]-1-(10H-phenothiazin-10-yl)ethanone
Smiles: CCCc1nc(SCC(=O)N2c3ccccc3Sc3c2cccc3)nc(c1)O

STK677330
Synonyms: N-(3,5-dichlorophenyl)-1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
Smiles: CCOc1ccc(cc1)N1CC(CC1=O)C(=O)Nc1cc(Cl)cc(c1)Cl

STK677331
Synonyms: N-(butan-2-yl)-5-oxo-1-[4-(propan-2-yl)phenyl]pyrrolidine-3-carboxamide
Smiles: CCC(NC(=O)C1CC(=O)N(C1)c1ccc(cc1)C(C)C)C

STK677333
Synonyms: 5-(4-nitro-1H-pyrazol-1-yl)-1H-tetrazole
Smiles: [O-][N+](=O)c1cnn(c1)c1nnn[nH]1

STK677334
Synonyms: pyridin-2-amine1-oxide
Smiles: Nc1cccc[n+]1[O-]

STK677335
Synonyms: 4-amino-N-[3-(morpholin-4-yl)propyl]-1,2,5-oxadiazole-3-carboxamide
Smiles: O=C(c1nonc1N)NCCCN1CCOCC1

STK677337
Synonyms: 5,5,6-trimethyl-2-(phenylethynyl)bicyclo[2.2.1]heptan-2-ol
Smiles: CC1C2CC(C1(C)C)CC2(O)C#Cc1ccccc1

STK677341
Synonyms: 2-[4-methyl-3-(morpholin-4-ylsulfonyl)phenyl]-2-oxoethyl3,4-dimethoxybenzoate
Smiles: COc1cc(ccc1OC)C(=O)OCC(=O)c1ccc(c(c1)S(=O)(=O)N1CCOCC1)C

STK677342
Synonyms: 5-methoxy-2-sulfobenzoicacid
Smiles: COc1ccc(c(c1)C(=O)O)S(=O)(=O)O

STK677343
Synonyms: methyl3-{[4-(ethoxycarbonyl)phenyl]sulfamoyl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NS(=O)(=O)c1cccc(c1)C(=O)OC

STK677344
Synonyms: 3-hydroxy-2-(2-methoxyphenyl)-4H-chromen-4-one
Smiles: COc1ccccc1c1oc2ccccc2c(=O)c1O

STK677345
Synonyms: 5-(hydroxymethyl)-1'-[(4-methylpiperidin-1-yl)methyl]-5-nitrospiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Smiles: OCC1(COC2(OC1)C(=O)N(c1c2cccc1)CN1CCC(CC1)C)[N+](=O)[O-]

STK677346
Synonyms: 1'-[(4-benzylpiperidin-1-yl)methyl]-5-methyl-5-phenylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Smiles: O=C1N(CN2CCC(CC2)Cc2ccccc2)c2c(C31OCC(CO3)(C)c1ccccc1)cccc2

STK677349
Synonyms: 2-methyl-3-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]quinazolin-4(3H)-one
Smiles: FC(C(Oc1ccc(cc1)n1c(C)nc2c(c1=O)cccc2)(F)F)F

STK677350
Synonyms: 5-({[(5-tert-butyl-2-methylfuran-3-yl)carbonyl]amino}methyl)furan-2-carboxylicacid
Smiles: O=C(c1cc(oc1C)C(C)(C)C)NCc1ccc(o1)C(=O)O

STK677352
Synonyms: 5-({[(2,5-dimethylfuran-3-yl)carbonyl]amino}methyl)furan-2-carboxylicacid
Smiles: Cc1oc(c(c1)C(=O)NCc1ccc(o1)C(=O)O)C

STK677353
Synonyms: N-[(2-chlorophenyl)(4-chlorophenyl)methyl]-1-{(4-methoxyphenyl)[(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino}cyclopentanecarboxamide
Smiles: COc1ccc(cc1)N(C1(CCCC1)C(=O)NC(c1ccccc1Cl)c1ccc(cc1)Cl)C(=O)CSc1[nH]ncn1

STK677354
Synonyms: N-{1,3-benzodioxol-5-yl[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]methyl}-N-methylacetamide
Smiles: CC(=O)N(C(c1nnnn1c1c(C)cccc1C)c1ccc2c(c1)OCO2)C

STK677356
Synonyms: 8-(diethylamino)-7-[2-(3-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cccc(c1)C(=O)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N(CC)CC

STK677359
Synonyms: (6'-amino-5'-cyano-2-oxo-3'-propyl-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-1(2H)-yl)aceticacid
Smiles: CCCc1n[nH]c2c1C1(C(=C(O2)N)C#N)c2ccccc2N(C1=O)CC(=O)O

STK677360
Synonyms: 4-acetyl-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])CCN1CCOCC1

STK677361
Synonyms: N'-acetyl-2-hydroxy-2-octyl-N'-phenyldecanehydrazide
Smiles: CCCCCCCCC(C(=O)NN(c1ccccc1)C(=O)C)(CCCCCCCC)O

STK677362
Synonyms: 7-hydroxy-4,8-dimethyl-6-nitro-2H-chromen-2-one
Smiles: O=c1cc(C)c2c(o1)c(C)c(c(c2)[N+](=O)[O-])O

STK677363
Synonyms: 6-{2-(1,3-benzodioxol-5-yl)-4-hydroxy-3-[(4-methoxyphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}hexanoicacid
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc2c(c1)OCO2)CCCCCC(=O)O

STK677364
Synonyms: 1-(piperidin-1-yl)-3-(4-propoxyphenyl)pentan-3-ol
Smiles: CCCOc1ccc(cc1)C(CCN1CCCCC1)(CC)O

STK677366
Synonyms: 2-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-nitro-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1CCc2c1cccc2)CSc1nc2c(s1)cc(cc2)N1C(=O)c2c(C1=O)cccc2[N+](=O)[O-]

STK677368
Synonyms: 3-{[(3E)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]amino}-N-phenylbenzenesulfonamide
Smiles: O=C1Nc2c(/C/1=N\c1cccc(c1)S(=O)(=O)Nc1ccccc1)cccc2

STK677369
Synonyms: N-(2-chlorocyclopentyl)-4-methylbenzenesulfonamide
Smiles: ClC1CCCC1NS(=O)(=O)c1ccc(cc1)C

STK677370
Synonyms: 1-[(2,5-dimethylfuran-3-yl)carbonyl]proline
Smiles: OC(=O)C1CCCN1C(=O)c1cc(oc1C)C

STK677371
Synonyms: 1-[(5-tert-butyl-2-methylfuran-3-yl)carbonyl]proline
Smiles: OC(=O)C1CCCN1C(=O)c1cc(oc1C)C(C)(C)C

STK677373
Synonyms: ethyl4-(aminomethyl)-2,5-dimethylfuran-3-carboxylate
Smiles: CCOC(=O)c1c(C)oc(c1CN)C

STK677375
Synonyms: ethyl4-(aminomethyl)-5-methylfuran-2-carboxylate
Smiles: CCOC(=O)c1cc(c(o1)C)CN

STK677376
Synonyms: 6,8-dibromo-2-(4-bromophenyl)quinoline-4-carboxylicacid
Smiles: Brc1ccc(cc1)c1cc(C(=O)O)c2c(n1)c(Br)cc(c2)Br

STK677377
Synonyms: 4-[5-({2-[(3-hydroxyphenyl)amino]-2-oxoethyl}sulfanyl)-1H-tetrazol-1-yl]benzoicacid
Smiles: O=C(Nc1cccc(c1)O)CSc1nnnn1c1ccc(cc1)C(=O)O

STK677379
Synonyms: 4-(4-methylphenyl)-2-(2-phenylethyl)phthalazin-1(2H)-one
Smiles: Cc1ccc(cc1)c1nn(CCc2ccccc2)c(=O)c2c1cccc2

STK677380
Synonyms: methyl3-amino-6-methyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate
Smiles: COC(=O)c1sc2c(c1N)cc1c(n2)CCC(C1)C

STK677381
Synonyms: 4-amino-5-(biphenyl-4-ylcarbonyl)-2-(phenylamino)thiophene-3-carbonitrile
Smiles: N#Cc1c(Nc2ccccc2)sc(c1N)C(=O)c1ccc(cc1)c1ccccc1

STK677382
Synonyms: 5,5'-biphenyl-4,4'-diylbis(2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one)
Smiles: O=C1CC(C)(C)CC2=C1C(Nc1c2c2ccccc2cc1)c1ccc(cc1)c1ccc(cc1)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3

STK677385
Synonyms: 3-{[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxy}-5-[(nonadecafluorononyl)oxy]aniline
Smiles: Nc1cc(cc(c1)OC(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OC(=C(C(C(F)(F)F)(C(F)(F)F)F)C(C(F)(F)F)(C(F)(F)F)F)C(F)(F)F

STK677387
Synonyms: 3-[(4-chlorophenyl)carbonyl]-6-(piperidin-1-ylsulfonyl)-1,3-benzoxazol-2(3H)-one
Smiles: Clc1ccc(cc1)C(=O)n1c(=O)oc2c1ccc(c2)S(=O)(=O)N1CCCCC1

STK677388
Synonyms: 3-[(2,4-dichlorophenyl)carbonyl]-6-(piperidin-1-ylsulfonyl)-1,3-benzoxazol-2(3H)-one
Smiles: Clc1ccc(c(c1)Cl)C(=O)n1c(=O)oc2c1ccc(c2)S(=O)(=O)N1CCCCC1

STK677389
Synonyms: 3-(5-fluoro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoicacid
Smiles: OC(=O)CCN1C(=O)c2c(C1=O)cc(cc2)F

STK677391
Synonyms: 1,3-dimethyl-1',3'-dipropyloctahydro-5H,5'H-5,5'-bi[1,3]dioxolo[4,5-c][1,2,5]thiadiazole2,2,2',2'-tetraoxide
Smiles: CCCN1C2OC(OC2N(S1(=O)=O)CCC)C1OC2C(O1)N(S(=O)(=O)N2C)C

STK677393
Synonyms: 4-[6-amino-5-cyano-3-(3,4-dichlorophenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-bromo-6-ethoxyphenylmorpholine-4-carboxylate
Smiles: CCOc1cc(cc(c1OC(=O)N1CCOCC1)Br)C1C(=C(N)Oc2c1c(n[nH]2)c1ccc(c(c1)Cl)Cl)C#N

STK677394
Synonyms: 6-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc3OCOc3cc1Br)c(n[nH]2)c1cc(OC)c(c(c1)OC)OC

STK677395
Synonyms: 4-[6-amino-5-cyano-3-(4-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-chloro-6-methoxyphenylmorpholine-4-carboxylate
Smiles: COc1ccc(cc1)c1n[nH]c2c1C(c1cc(Cl)c(c(c1)OC)OC(=O)N1CCOCC1)C(=C(O2)N)C#N

STK677396
Synonyms: 4-[6-amino-5-cyano-3-(4-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-bromo-6-ethoxyphenylmorpholine-4-carboxylate
Smiles: CCOc1cc(cc(c1OC(=O)N1CCOCC1)Br)C1C(=C(N)Oc2c1c(n[nH]2)c1ccc(cc1)OC)C#N

STK677397
Synonyms: ethyl3-oxo-3-(3,4,5-trimethoxyphenyl)propanoate
Smiles: CCOC(=O)CC(=O)c1cc(OC)c(c(c1)OC)OC

STK677398
Synonyms: 1,1'-(2-chloro-4-nitrobenzene-1,3-diyl)bis(4-methylpiperazine)
Smiles: CN1CCN(CC1)c1ccc(c(c1Cl)N1CCN(CC1)C)[N+](=O)[O-]

STK677399
Synonyms: diethyl2,6-diamino-4-(4-chlorophenyl)benzo[1,2-b:4,5-b']difuran-3,7-dicarboxylate
Smiles: CCOC(=O)c1c(N)oc2c1cc1oc(c(c1c2c1ccc(cc1)Cl)C(=O)OCC)N

STK677400
Synonyms: N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-(quinolin-8-ylsulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C)CSc1cccc2c1nccc2

STK677401
Synonyms: 6-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)Oc2c1c(n[nH]2)c1ccncc1)C#N

STK677402
Synonyms: 2-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C#N

STK677403
Synonyms: 2-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)Oc2c1c(=O)oc(c2)C)C#N

STK677404
Synonyms: 6-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-3-(propan-2-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)Oc2c1c(n[nH]2)C(C)C)C#N

STK677405
Synonyms: 4-[6-amino-5-cyano-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-ethoxy-6-nitrophenylmorpholine-4-carboxylate
Smiles: CCOc1cc(cc(c1OC(=O)N1CCOCC1)[N+](=O)[O-])C1C(=C(N)Oc2c1c(n[nH]2)c1ccncc1)C#N

STK677406
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-4-(4-methylpiperazin-1-yl)-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
Smiles: CN1CCN(CC1)c1nc(Nc2ccc(cc2)OC(Cl)(F)F)nc(n1)OCC(F)(F)F

STK677407
Synonyms: 4-(4-methylpiperazin-1-yl)-6-(2,2,2-trifluoroethoxy)-N-[4-(trifluoromethoxy)phenyl]-1,3,5-triazin-2-amine
Smiles: CN1CCN(CC1)c1nc(Nc2ccc(cc2)OC(F)(F)F)nc(n1)OCC(F)(F)F

STK677408
Synonyms: 1-[(3,4-dichlorophenyl)sulfonyl]cyclopropanecarboxylicacid
Smiles: OC(=O)C1(CC1)S(=O)(=O)c1ccc(c(c1)Cl)Cl

STK677411
Synonyms: (5Z)-3-(4-bromophenyl)-5-{3-chloro-4-[(2-fluorobenzyl)oxy]-5-methoxybenzylidene}-2-imino-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C/2\SC(=N)N(C2=O)c2ccc(cc2)Br)cc(c1OCc1ccccc1F)Cl

STK677412
Synonyms: 2-bromo-4,6-dinitro-N-phenylaniline
Smiles: Brc1cc(cc(c1Nc1ccccc1)[N+](=O)[O-])[N+](=O)[O-]

STK677413
Synonyms: 4-chloro-N-(2-chloro-2-cyanoethyl)benzenesulfonamide
Smiles: ClC(C#N)CNS(=O)(=O)c1ccc(cc1)Cl

STK677414
Synonyms: N'-{hydroxy[bis(4-methylphenyl)]acetyl}-N-phenyl-2-(piperidin-1-yl)pyridine-3-carbohydrazide
Smiles: Cc1ccc(cc1)C(C(=O)NN(C(=O)c1cccnc1N1CCCCC1)c1ccccc1)(c1ccc(cc1)C)O

STK677416
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-1,3-benzoxazol-2-amine
Smiles: FC(Oc1ccc(cc1)Nc1nc2c(o1)cccc2)(Cl)F

STK677417
Synonyms: 3-(diphenylmethoxy)-1,5-diphenyl-4-(phenylsulfonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1N(c2ccccc2)C(C(=C1OC(c1ccccc1)c1ccccc1)S(=O)(=O)c1ccccc1)c1ccccc1

STK677418
Synonyms: [6'-amino-5'-cyano-3'-(4-ethoxyphenyl)-2-oxo-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-1(2H)-yl]aceticacid
Smiles: CCOc1ccc(cc1)c1n[nH]c2c1C1(C(=C(O2)N)C#N)c2ccccc2N(C1=O)CC(=O)O

STK677419
Synonyms: (2'-amino-3'-cyano-7'-methyl-2,5'-dioxo-5'H-spiro[indole-3,4'-pyrano[4,3-b]pyran]-1(2H)-yl)aceticacid
Smiles: N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)CC(=O)O)c(=O)oc(c2)C

STK677420
Synonyms: 3,3'-(1-oxopropane-1,3-diyl)bis(6-chloro-1,3-benzoxazol-2(3H)-one)
Smiles: Clc1ccc2c(c1)oc(=O)n2CCC(=O)n1c(=O)oc2c1ccc(c2)Cl

STK677421
Synonyms: 3-[3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanoyl]-1,3-benzoxazol-2(3H)-one
Smiles: O=c1sc2c(n1CCC(=O)n1c(=O)oc3c1cccc3)cccc2

STK677422
Synonyms: 6-chloro-N-cyclohexyl-N'-(4-methylphenyl)-1,3,5-triazine-2,4-diamine
Smiles: Cc1ccc(cc1)Nc1nc(NC2CCCCC2)nc(n1)Cl

STK677426
Synonyms: (5E)-5-{[(4-bromophenyl)carbamoyl]imino}-3-(1-phenylpropan-2-yl)-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide
Smiles: Brc1ccc(cc1)NC(=O)/N=C\1/ON=[N+]([CH-]1)C(Cc1ccccc1)C

STK677427
Synonyms: methyl2-{[2-(4-fluorophenoxy)propanoyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)C(Oc2ccc(cc2)F)C)sc(c1C)C

STK677428
Synonyms: 1-benzyl-N-(2-ethylphenyl)-3-nitro-1H-pyrazole-5-carboxamide
Smiles: CCc1ccccc1NC(=O)c1cc(nn1Cc1ccccc1)[N+](=O)[O-]

STK677430
Synonyms: ethyl1-[2-(dimethylamino)ethyl]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1cc2c(n1CCN(C)C)cccc2

STK677431
Synonyms: 1-benzyl-N-(2,4-difluorophenyl)-3-nitro-1H-pyrazole-5-carboxamide
Smiles: Fc1ccc(c(c1)F)NC(=O)c1cc(nn1Cc1ccccc1)[N+](=O)[O-]

STK677435
Synonyms: N-[3,5-bis(trifluoromethyl)phenyl]-2-{[3-cyano-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)nc(cc1C(F)(F)F)c1cccs1

STK677436
Synonyms: 2,2'-(1,2,4-thiadiazole-3,5-diyldisulfanediyl)bis{N-[2-(trifluoromethyl)phenyl]acetamide}
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1snc(n1)SCC(=O)Nc1ccccc1C(F)(F)F

STK677438
Synonyms: N-[3,5-bis(trifluoromethyl)phenyl]-2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]acetamide
Smiles: O=C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)CSc1nc(c(o1)c1ccccc1)c1ccccc1

STK677439
Synonyms: 2,2'-[(4-cyano-1,2-thiazole-3,5-diyl)disulfanediyl]bis{N-[2-(trifluoromethyl)phenyl]acetamide}
Smiles: N#Cc1c(SCC(=O)Nc2ccccc2C(F)(F)F)snc1SCC(=O)Nc1ccccc1C(F)(F)F

STK677440
Synonyms: ethyl1-[2-(2,3-dichlorophenoxy)ethyl]-5-hydroxy-2-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(O)cc2)CCOc1cccc(c1Cl)Cl

STK677441
Synonyms: 1'-{[benzyl(methyl)amino]methyl}-5-methyl-5-phenylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Smiles: CN(CN1c2ccccc2C2(C1=O)OCC(CO2)(C)c1ccccc1)Cc1ccccc1

STK677442
Synonyms: 3-nitro-4-(2,2,3,3-tetrafluoropropoxy)-N-[2-(2,2,2-trifluoroethoxy)phenyl]benzamide
Smiles: FC(C(COc1ccc(cc1[N+](=O)[O-])C(=O)Nc1ccccc1OCC(F)(F)F)(F)F)F

STK677443
Synonyms: 3-nitro-4-(2,2,3,3-tetrafluoropropoxy)-N-[2-(2,2,2-trifluoroethoxy)-5-(trifluoromethyl)phenyl]benzamide
Smiles: O=C(c1ccc(c(c1)[N+](=O)[O-])OCC(C(F)F)(F)F)Nc1cc(ccc1OCC(F)(F)F)C(F)(F)F

STK677444
Synonyms: 2-({[(3-methylfuran-2-yl)carbonyl]amino}methyl)furan-3-carboxylicacid
Smiles: O=C(c1occc1C)NCc1occc1C(=O)O

STK677445
Synonyms: N'-[(E)-{3-nitro-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl}methylidene]-2-(9-oxoacridin-10(9H)-yl)acetohydrazide
Smiles: O=C(Cn1c2ccccc2c(=O)c2c1cccc2)N/N=C/c1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1ccccc1

STK677448
Synonyms: 5-benzyl-3-(2,4-dihydroxyphenyl)-1-methyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: Oc1ccc(c(c1)O)C1NC(C2C1C(=O)N(C2=O)Cc1ccccc1)(C)C(=O)O

STK677449
Synonyms: 5-(4-bromophenyl)-3-(2-hydroxyphenyl)-1-[2-(methylsulfanyl)ethyl]-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: CSCCC1(NC(C2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1O)C(=O)O

STK677450
Synonyms: 5-(4-bromophenyl)-3-(2,4-dihydroxyphenyl)-1-methyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: Brc1ccc(cc1)N1C(=O)C2C(C1=O)C(NC2c1ccc(cc1O)O)(C)C(=O)O

STK677451
Synonyms: 3-(2-hydroxyphenyl)-1-methyl-5-(naphthalen-1-yl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylicacid
Smiles: O=C1N(c2cccc3c2cccc3)C(=O)C2C1C(NC2(C)C(=O)O)c1ccccc1O

STK677452
Synonyms: 7-(3-nitrophenyl)-1,6-diazabicyclo[4.1.0]heptane
Smiles: [O-][N+](=O)c1cccc(c1)C1N2N1CCCC2

STK677454
Synonyms: 2-(benzylsulfanyl)-4-methoxybenzonitrile
Smiles: COc1ccc(c(c1)SCc1ccccc1)C#N

STK677460
Synonyms: 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-4-(morpholin-4-yl)benzoicacid
Smiles: OC(=O)c1ccc(c(c1)N1C(=O)C2C(C1=O)C1CC2C=C1)N1CCOCC1

STK677462
Synonyms: 2-(3,5-dichloro-2-methoxyphenyl)-3-{[(E)-(3,5-dichloro-2-methoxyphenyl)methylidene]amino}-7-nitro-2,3-dihydroquinazolin-4(1H)-one
Smiles: COc1c(Cl)cc(cc1C1Nc2cc(ccc2C(=O)N1/N=C/c1cc(Cl)cc(c1OC)Cl)[N+](=O)[O-])Cl

STK677463
Synonyms: (8xi,9xi,14xi)-17-(acetylamino)androst-5-en-3-ylacetate
Smiles: CC(=O)NC1CCC2[C@]1(C)CCC1C2CC=C2[C@]1(C)CCC(C2)OC(=O)C

STK677464
Synonyms: 4-[5-(pyridin-3-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Nc1nonc1c1noc(n1)c1cccnc1

STK677466
Synonyms: 4-{5-[(4-bromophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,2,5-oxadiazol-3-amine
Smiles: Brc1ccc(cc1)OCc1onc(n1)c1nonc1N

STK677467
Synonyms: 4-[5-(1-methyl-1H-pyrazol-5-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Cn1nccc1c1onc(n1)c1nonc1N

STK677468
Synonyms: 6'-amino-4-bromo-5-methyl-2-oxo-3'-(3,4,5-trimethoxyphenyl)-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31C(=O)Nc1c3c(Br)c(cc1)C)c(n[nH]2)c1cc(OC)c(c(c1)OC)OC

STK677469
Synonyms: 2-[(furan-2-ylcarbonyl)amino]-4-nitrobenzoicacid
Smiles: OC(=O)c1ccc(cc1NC(=O)c1ccco1)[N+](=O)[O-]

STK677470
Synonyms: 6-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)Oc2c1c(n[nH]2)c1cc(OC)c(c(c1)OC)OC)C#N

STK677471
Synonyms: 6-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc3OCOc3cc1Br)c(n[nH]2)c1ccncc1

STK677472
Synonyms: 6-{[4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-14-hydroxy-4-[(5-hydroxy-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-3,5,7,13,15,16-hexamethyl-1,9-dioxacyclohexadecane-2,12-d
Smiles: COC1CC(OC2C(C)C(=O)OC(C)C(C)C(O)C(C)C(=O)CCOCC(C(C2C)OC2OC(C)CC(C2O)N(C)C)C)OC(C1O)C

STK677473
Synonyms: 11-(3-bromophenyl)-3,3-dimethyl-10-[(3,4,5-trimethoxyphenyl)carbonyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1c(OC)cc(cc1OC)C(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)Br)C(=O)CC(C2)(C)C

STK677474
Synonyms: 10-[(3-chlorophenyl)carbonyl]-3-(4-methoxyphenyl)-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccs1)C(=O)c1cccc(c1)Cl

STK677475
Synonyms: 4-[3-(4-fluorophenyl)-11-(3-methoxyphenyl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoicacid
Smiles: COc1cccc(c1)C1C2=C(CC(CC2=O)c2ccc(cc2)F)Nc2c(N1C(=O)CCC(=O)O)cccc2

STK677476
Synonyms: 11-[4-(diethylamino)phenyl]-3-(4-fluorophenyl)-10-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCN(c1ccc(cc1)C1C2=C(Nc3c(N1C(=O)c1ccccc1)cccc3)CC(CC2=O)c1ccc(cc1)F)CC

STK677477
Synonyms: 10-[(3,4-dichlorophenyl)carbonyl]-11-[4-(diethylamino)phenyl]-3-(4-fluorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCN(c1ccc(cc1)C1C2=C(Nc3c(N1C(=O)c1ccc(c(c1)Cl)Cl)cccc3)CC(CC2=O)c1ccc(cc1)F)CC

STK677478
Synonyms: 1-[3-(diethylamino)propyl]-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)thiourea
Smiles: CCN(CCCNC(=S)Nc1c(C)n(n(c1=O)c1ccccc1)C)CC

STK677479
Synonyms: 5,7-dibromo-2-methyl-1,3-benzoxazole
Smiles: Brc1cc(Br)c2c(c1)nc(o2)C

STK677481
Synonyms: 4-[(Z)-(2-{6-[(2-fluorophenyl)amino][1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazinylidene)methyl]-2-methoxy-6-nitrophenol
Smiles: COc1cc(/C=N\Nc2nc3nonc3nc2Nc2ccccc2F)cc(c1O)[N+](=O)[O-]

STK677483
Synonyms: 2-oxo-2-(thiophen-2-yl)ethyl3-(morpholin-4-ylsulfonyl)benzoate
Smiles: O=C(c1cccc(c1)S(=O)(=O)N1CCOCC1)OCC(=O)c1cccs1

STK677484
Synonyms: 2-(4-bromophenyl)-2-oxoethyl1-(ethylsulfonyl)piperidine-4-carboxylate
Smiles: CCS(=O)(=O)N1CCC(CC1)C(=O)OCC(=O)c1ccc(cc1)Br

STK677489
Synonyms: 2-(3-ethoxy-4-{[5-(methoxycarbonyl)furan-2-yl]methoxy}phenyl)-1,3-thiazolidine-4-carboxylicacid
Smiles: CCOc1cc(ccc1OCc1ccc(o1)C(=O)OC)C1SCC(N1)C(=O)O

STK677490
Synonyms: 4-[5-(3-chloro-1-benzothiophen-2-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: Nc1nonc1c1noc(n1)c1sc2c(c1Cl)cccc2

STK677492
Synonyms: 2-{4-[(E)-(6,7-dimethyl-3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-2-methoxyphenoxy}-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: COc1cc(ccc1OCC(=O)Nc1ccc(cc1)OC(F)(F)F)/C=c\1/sc2n(c1=O)c1c(n2)cc(c(c1)C)C

STK677493
Synonyms: methyl4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carboxylate
Smiles: COC(=O)N1CCC(=O)Nc2c1cccc2

STK677494
Synonyms: 3-imino-1,7-dimethyl-5-(pyridin-3-yl)-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1c1cccnc1)(C(C2(C#N)C#N)C)C

STK677495
Synonyms: ethyl4-[(1E)-1-chloronon-1-en-1-yl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Smiles: CCCCCCC/C=C(\c1c(C)[nH]c(c1C)C(=O)OCC)/Cl

STK677497
Synonyms: 1-(2-fluorophenyl)-4,6-dimethyl-2-oxo-1,2-dihydropyridine-3-carboxylicacid
Smiles: Fc1ccccc1n1c(C)cc(c(c1=O)C(=O)O)C

STK677498
Synonyms: 1-(3-chlorophenyl)-3-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1H-1,2,4-triazol-3-yl]urea
Smiles: COc1nc(OC)nc(n1)n1cnc(n1)NC(=O)Nc1cccc(c1)Cl

STK677499
Synonyms: 4-methyl-N-(1H-tetrazol-5-yl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1nnn[nH]1

STK677500
Synonyms: 8-methoxy-N,N-dimethylquinoline-5-sulfonamide
Smiles: COc1ccc(c2c1nccc2)S(=O)(=O)N(C)C

STK677501
Synonyms: 1-[3-(aminomethyl)tricyclo[3.3.1.1~3,7~]dec-1-yl]butan-1-amine
Smiles: CCCC(C12CC3CC(C1)CC(C2)(C3)CN)N

STK677502
Synonyms: 7-(4-chlorophenyl)-1,6-diazabicyclo[4.1.0]heptane
Smiles: Clc1ccc(cc1)C1N2N1CCCC2

STK677504
Synonyms: 3,3'-hexane-1,6-diylbis(4-hydroxy-4,7,7,9,9-pentamethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one)
Smiles: O=C1OC2(C(N1CCCCCCN1C(=O)OC3(C1(C)O)CC(C)(C)NC(C3)(C)C)(C)O)CC(C)(C)NC(C2)(C)C

STK677506
Synonyms: [6'-amino-5'-cyano-2-oxo-3'-(propan-2-yl)-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-1(2H)-yl]aceticacid
Smiles: N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)CC(=O)O)c(n[nH]2)C(C)C

STK677507
Synonyms: [6'-amino-5'-cyano-3'-(3,4-dimethoxyphenyl)-2-oxo-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-1(2H)-yl]aceticacid
Smiles: N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)CC(=O)O)c(n[nH]2)c1ccc(c(c1)OC)OC

STK677509
Synonyms: 1-(2-chloro-10H-phenothiazin-10-yl)-2-{4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl}ethanone
Smiles: OCCOCCN1CCN(CC1)CC(=O)N1c2ccccc2Sc2c1cc(Cl)cc2

STK677511
Synonyms: 6'-amino-1-methyl-3'-(propan-2-yl)-1'H-spiro[piperidine-4,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31CCN(CC3)C)c(n[nH]2)C(C)C

STK677512
Synonyms: 6'-amino-1-benzyl-3'-(propan-2-yl)-1'H-spiro[piperidine-4,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31CCN(CC3)Cc1ccccc1)c(n[nH]2)C(C)C

STK677513
Synonyms: 2-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)OC2=C1C(=O)CC(C2)c1ccco1)C#N

STK677514
Synonyms: 2-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)Oc2c1c(=O)oc1c2cccc1)C#N

STK677515
Synonyms: [6'-amino-3'-(4-butoxyphenyl)-5'-cyano-2-oxo-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-1(2H)-yl]aceticacid
Smiles: CCCCOc1ccc(cc1)c1n[nH]c2c1C1(C(=C(O2)N)C#N)c2ccccc2N(C1=O)CC(=O)O

STK677517
Synonyms: 2-{5-[3-(4-amino-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5-yl]pentyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CCCCCc2onc(n2)c2nonc2N)C(=O)c2c1cccc2

STK677519
Synonyms: 4-[6-amino-5-cyano-3-(4-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-ethoxy-6-nitrophenylthiophene-2-carboxylate
Smiles: CCOc1cc(cc(c1OC(=O)c1cccs1)[N+](=O)[O-])C1C(=C(N)Oc2c1c(n[nH]2)c1ccc(cc1)OC)C#N

STK677520
Synonyms: 4-(2-amino-3-cyano-5-oxo-4H,5H-pyrano[3,2-c]chromen-4-yl)-2-ethoxy-6-nitrophenylthiophene-2-carboxylate
Smiles: CCOc1cc(cc(c1OC(=O)c1cccs1)[N+](=O)[O-])C1C(=C(N)Oc2c1c(=O)oc1c2cccc1)C#N

STK677521
Synonyms: 6,8-dibromo-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: O=C1CCNc2c(N1)cc(Br)cc2Br

STK677523
Synonyms: 4-[5-(4-chloro-3-nitrophenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: [O-][N+](=O)c1cc(ccc1Cl)c1onc(n1)c1nonc1N

STK677524
Synonyms: 4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Smiles: COc1cccc(c1)c1onc(n1)c1nonc1N

STK677525
Synonyms: 6,7-dimethoxy-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cccc(c1)C1NCCc2c1cc(OC)c(c2)OC

STK677527
Synonyms: (2Z,5E)-3-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylimino)-5-{4-[(2-fluorobenzyl)oxy]benzylidene}-1,3-thiazolidin-4-one
Smiles: O=C1/C(=C\c2ccc(cc2)OCc2ccccc2F)/S/C(=N\c2ccc3c(c2)OCO3)/N1c1ccc2c(c1)OCO2

STK677528
Synonyms: 6-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-3-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)Oc2c1c(n[nH]2)c1ccccc1)C#N

STK677529
Synonyms: 6-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-3-(4-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)Oc2c1c(n[nH]2)c1ccc(cc1)OC)C#N

STK677530
Synonyms: 4-(2-amino-3-cyano-5-oxo-4H,5H-pyrano[3,2-c]chromen-4-yl)-2-ethoxy-6-nitrophenylmorpholine-4-carboxylate
Smiles: CCOc1cc(cc(c1OC(=O)N1CCOCC1)[N+](=O)[O-])C1C(=C(N)Oc2c1c(=O)oc1c2cccc1)C#N

STK677531
Synonyms: N-methyl-6-(2,2,2-trifluoroethoxy)-N'-[4-(trifluoromethoxy)phenyl]-1,3,5-triazine-2,4-diamine
Smiles: CNc1nc(Nc2ccc(cc2)OC(F)(F)F)nc(n1)OCC(F)(F)F

STK677533
Synonyms: 2,4-diazido-6-(benzylsulfinyl)benzonitrile
Smiles: [N-]=[N+]=Nc1cc(N=[N+]=[N-])c(c(c1)S(=O)Cc1ccccc1)C#N

STK677534
Synonyms: 2-(5-{(E)-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: N=C1S/C(=C/c2ccc(o2)c2ccccc2C(=O)O)/C(=O)N1c1nccs1

STK677535
Synonyms: 6-amino-3-(3,4-dichlorophenyl)-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)Oc2c1c(n[nH]2)c1ccc(c(c1)Cl)Cl)C#N

STK677536
Synonyms: 4-[2-amino-3-cyano-7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl]-2-ethoxy-6-nitrophenylthiophene-2-carboxylate
Smiles: CCOc1cc(cc(c1OC(=O)c1cccs1)[N+](=O)[O-])C1C(=C(N)OC2=C1C(=O)CC(C2)c1ccco1)C#N

STK677537
Synonyms: 2-[6-amino-3-(4-butoxyphenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-4-bromophenylmorpholine-4-carboxylate
Smiles: CCCCOc1ccc(cc1)c1n[nH]c2c1C(C(=C(O2)N)C#N)c1cc(Br)ccc1OC(=O)N1CCOCC1

STK677538
Synonyms: 2-nitro-4-[(2,3,3,3-tetrafluoro-2-methoxypropanoyl)amino]benzoicacid
Smiles: COC(C(F)(F)F)(C(=O)Nc1ccc(c(c1)[N+](=O)[O-])C(=O)O)F

STK677541
Synonyms: 3-nitro-5-[(2,3,3,3-tetrafluoro-2-methoxypropanoyl)amino]benzoicacid
Smiles: COC(C(F)(F)F)(C(=O)Nc1cc(cc(c1)C(=O)O)[N+](=O)[O-])F

STK677543
Synonyms: 4-hydroxy-3-(2-hydroxy-2-phenylethyl)-4,5,5-trimethyl-1,3-oxazolidin-2-one
Smiles: OC(c1ccccc1)CN1C(=O)OC(C1(C)O)(C)C

STK677547
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-2-{4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl}acetamide
Smiles: OCCOCCN1CCN(CC1)CC(=O)Nc1ccc(cc1)OC(Cl)(F)F

STK677548
Synonyms: 2-{4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl}-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: OCCOCCN1CCN(CC1)CC(=O)Nc1ccc(cc1)OC(F)(F)F

STK677549
Synonyms: 6-amino-3-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)Oc2c1c(n[nH]2)c1ccc(cc1)Cl)C#N

STK677550
Synonyms: [6'-amino-3'-(4-chlorophenyl)-5'-cyano-2-oxo-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-1(2H)-yl]aceticacid
Smiles: N#CC1=C(N)Oc2c(C31C(=O)N(c1c3cccc1)CC(=O)O)c(n[nH]2)c1ccc(cc1)Cl

STK677552
Synonyms: 1-[4-fluoro-2-nitro-5-(pyrrolidin-1-yl)phenyl]piperazine
Smiles: [O-][N+](=O)c1cc(F)c(cc1N1CCNCC1)N1CCCC1

STK677554
Synonyms: (3-bromo-4-methoxyphenyl)(4-{4-[(3,4-difluorophenyl)carbonyl]piperazin-1-yl}-3-fluorophenyl)methanone
Smiles: COc1ccc(cc1Br)C(=O)c1ccc(c(c1)F)N1CCN(CC1)C(=O)c1ccc(c(c1)F)F

STK677556
Synonyms: 1-(4-{4-[(2,3-difluorophenyl)carbonyl]piperazin-1-yl}-3-fluorophenyl)ethanone
Smiles: Fc1cc(ccc1N1CCN(CC1)C(=O)c1cccc(c1F)F)C(=O)C

STK677557
Synonyms: 1-{2-fluoro-4-[(1E)-1-(2-phenylhydrazinylidene)ethyl]phenyl}-4-methylpiperazine
Smiles: CN1CCN(CC1)c1ccc(cc1F)/C(=N/Nc1ccccc1)/C

STK677558
Synonyms: (3-bromo-4-methoxyphenyl)(3,4-difluorophenyl)methanone
Smiles: COc1ccc(cc1Br)C(=O)c1ccc(c(c1)F)F

STK677560
Synonyms: 5-[4-({4-[chloro(difluoro)methoxy]phenyl}amino)phthalazin-1-yl]-2-methyl-N-(2-methylbut-3-yn-2-yl)benzenesulfonamide
Smiles: C#CC(NS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)Nc1ccc(cc1)OC(Cl)(F)F)(C)C

STK677561
Synonyms: 5-[4-({4-[chloro(difluoro)methoxy]phenyl}amino)phthalazin-1-yl]-2-methyl-N-(propan-2-yl)benzenesulfonamide
Smiles: CC(NS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)Nc1ccc(cc1)OC(Cl)(F)F)C

STK677562
Synonyms: N-tert-butyl-5-[4-({4-[chloro(difluoro)methoxy]phenyl}amino)phthalazin-1-yl]-2-methylbenzenesulfonamide
Smiles: Cc1ccc(cc1S(=O)(=O)NC(C)(C)C)c1nnc(c2c1cccc2)Nc1ccc(cc1)OC(Cl)(F)F

STK677563
Synonyms: N-(4-cyclopropyl-1,3-thiazol-2-yl)-2,3,3,3-tetrafluoro-2-methoxypropanamide
Smiles: COC(C(F)(F)F)(C(=O)Nc1scc(n1)C1CC1)F

STK677564
Synonyms: [6'-amino-5'-cyano-2-oxo-3'-(3,4,5-trimethoxyphenyl)-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-1(2H)-yl]aceticacid
Smiles: N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)CC(=O)O)c(n[nH]2)c1cc(OC)c(c(c1)OC)OC

STK677565
Synonyms: 2-{[1-(1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}-N-(2-chlorophenyl)acetamide
Smiles: O=C(Nc1ccccc1Cl)CSc1nnnn1c1ccc2c(c1)OCO2

STK677567
Synonyms: 6-chloro-N,N'-di(prop-2-en-1-yl)-1,3,5-triazine-2,4-diamine
Smiles: C=CCNc1nc(NCC=C)nc(n1)Cl

STK677568
Synonyms: 4,6-dinitro-N,2-bis[4-(trifluoromethoxy)phenyl]-2H-indazol-3-amine1-oxide
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c2c(c1)[n+]([O-])n(c2Nc1ccc(cc1)OC(F)(F)F)c1ccc(cc1)OC(F)(F)F

STK677570
Synonyms: 5-(bicyclo[2.2.1]hept-5-en-2-yl)-4-hydroxy-4,5-dimethyl-3-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3-oxazolidin-2-one
Smiles: O=C1OC(C(N1C1CC(C)(C)NC(C1)(C)C)(C)O)(C)C1CC2CC1C=C2

STK677572
Synonyms: 7-(3-bromophenyl)-1,6-diazabicyclo[4.1.0]heptane
Smiles: Brc1cccc(c1)C1N2N1CCCC2

STK677573
Synonyms: 3-[2,6,6-trimethyl-4-oxo-3-(2,2,2-trichloroethyl)-4,5,6,7-tetrahydro-1H-indol-1-yl]propanoicacid
Smiles: OC(=O)CCn1c(C)c(c2c1CC(C)(C)CC2=O)CC(Cl)(Cl)Cl

STK677574
Synonyms: ethyl[2,6,6-trimethyl-4-oxo-3-(2,2,2-trichloroethyl)-4,5,6,7-tetrahydro-1H-indol-1-yl]acetate
Smiles: CCOC(=O)Cn1c(C)c(c2c1CC(C)(C)CC2=O)CC(Cl)(Cl)Cl

STK677575
Synonyms: 1-benzyl-2,6,6-trimethyl-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Smiles: O=C1CC(C)(C)Cc2c1c(CC(Cl)(Cl)Cl)c(n2Cc1ccccc1)C

STK677577
Synonyms: ethyl5-ethyl-4-phenyl-2-[(1,1,1-trifluoro-3-methoxy-2-{[(2-methoxyphenyl)carbonyl]amino}-3-oxopropan-2-yl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc(c1c1ccccc1)CC)NC(C(F)(F)F)(C(=O)OC)NC(=O)c1ccccc1OC

STK677578
Synonyms: 7-(2-aminoethyl)-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: NCCn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCCCC1

STK677579
Synonyms: N'-{3-[1,3-dimethyl-2,6-dioxo-8-(piperidin-1-yl)-1,2,3,6-tetrahydro-7H-purin-7-yl]propyl}-N,N-dimethylimidoformamide
Smiles: CN(/C=N\CCCn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCC1)C

STK677581
Synonyms: 1-butyl-3-(2-chloro-4,6-dimethylpyridin-3-yl)urea
Smiles: CCCCNC(=O)Nc1c(C)cc(nc1Cl)C

STK677582
Synonyms: 2,5-dichloro-N-(4-methoxyphenyl)-4,6-dimethylpyridine-3-sulfonamide
Smiles: COc1ccc(cc1)NS(=O)(=O)c1c(Cl)nc(c(c1C)Cl)C

STK677584
Synonyms: 2,5-dichloro-N-(4-methoxyphenyl)-4,6-dimethylpyridine-3-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(Cl)nc(c(c1C)Cl)C

STK677586
Synonyms: 4,4-diphenyl-2-(pyridin-2-yl)-1,4-dihydro-2H-3,1-benzoxazine
Smiles: c1ccc(nc1)C1Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1

STK677587
Synonyms: 3-(2,4-dimethylphenyl)-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Smiles: COCc1cc(C)nc2c1c1nnn(c(=O)c1s2)c1ccc(cc1C)C

STK677588
Synonyms: 4-azido-2-(benzylsulfinyl)benzonitrile
Smiles: [N-]=[N+]=Nc1ccc(c(c1)S(=O)Cc1ccccc1)C#N

STK677589
Synonyms: [(4,6-dihydroxypyrimidin-2-yl)sulfanyl]aceticacid
Smiles: OC(=O)CSc1nc(O)cc(n1)O

STK677590
Synonyms: [(1-fluoro-2,2,3,3-tetramethylcyclopropyl)ethynyl]benzene
Smiles: FC1(C#Cc2ccccc2)C(C1(C)C)(C)C

STK677592
Synonyms: 2,2-dimethyl-5-(1-methyl-2-phenyl-1H-indol-3-yl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Smiles: O=C1CC(C)(C)CC2=C1C(Nc1c2c2ccccc2cc1)c1c2ccccc2n(c1c1ccccc1)C

STK677593
Synonyms: 3-(3,5-dimethyl-1H-pyrazol-1-yl)-4H-1,2,4-triazole
Smiles: Cc1nn(c(c1)C)c1nnc[nH]1

STK677594
Synonyms: ethyl2-({3-ethoxy-2-[(ethoxycarbonyl)amino]-1,1,1-trifluoro-3-oxopropan-2-yl}amino)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Smiles: CCOC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1sc2c(c1C(=O)OCC)CCN(C2)C

STK677595
Synonyms: 2-[4-(4,5-diphenyl-1H-imidazol-2-yl)-2-methoxyphenoxy]-N-(2-phenylethyl)acetamide
Smiles: COc1cc(ccc1OCC(=O)NCCc1ccccc1)c1nc(c([nH]1)c1ccccc1)c1ccccc1

STK677596
Synonyms: 1-(piperidin-1-yl)-2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethanone
Smiles: O=C(N1CCCCC1)CSc1nnc2c(n1)n(C(C)C)c1c2cccc1

STK677597
Synonyms: N-(4-fluorophenyl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc2c(n1)n(C)c1c2cccc1

STK677600
Synonyms: 4-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]-3-phenylbutanoicacid
Smiles: OC(=O)CC(c1ccccc1)CNS(=O)(=O)c1cccc2c1nsn2

STK677604
Synonyms: [6'-amino-3'-(1,3-benzodioxol-5-yl)-5'-cyano-2-oxo-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-1(2H)-yl]aceticacid
Smiles: N#CC1=C(N)Oc2c(C31C(=O)N(c1c3cccc1)CC(=O)O)c(n[nH]2)c1ccc2c(c1)OCO2

STK677607
Synonyms: ethylN-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[(3-chlorophenyl)carbonyl]amino}-3,3,3-trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccc(c1)Cl)Nc1sc2c(c1C#N)CCC(C2)C(C)(C)C

STK677608
Synonyms: methylN-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[(4-chlorophenyl)carbonyl]amino}-3,3,3-trifluoroalaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1)Cl)Nc1sc2c(c1C#N)CCC(C2)C(C)(C)C