AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-4

SMILES stringlengths 2 1.18k	IUPAC stringlengths 6 1.79k
C#CCCNc1cccc(CO)c1	[3-(but-3-ynylamino)phenyl]methanol
CSc1ccc(NCC(O)CN2CCc3ccccc3C2)nn1	1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(6-methylsulfanylpyridazin-3-yl)amino]propan-2-ol
CC(Oc1ccc(OCc2ccccc2)cc1)C(=O)[O-]	2-(4-phenylmethoxyphenoxy)propanoate
CCC(=O)N1CCn2cc(C(F)(F)F)nc2C1	1-[2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one
COc1ccc2ncc(N(C)C)c([C@@H](O)CCC3(C(=O)O)CCN(CCOc4c(F)cc(F)cc4F)CC3)c2c1	4-[(3S)-3-[3-(dimethylamino)-6-methoxyquinolin-4-yl]-3-hydroxypropyl]-1-[2-(2,4,6-trifluorophenoxy)ethyl]piperidine-4-carboxylic acid
CC(CO)NC(C)CCC(=O)O	4-(1-hydroxypropan-2-ylamino)pentanoic acid
CC(C)c1ccc(-c2nc3c(N)nc(N)nc3nc2N)cc1	6-(4-propan-2-ylphenyl)pteridine-2,4,7-triamine
CCOc1cc(CNCCCNC)cc(Cl)c1OC(C)C	N'-[(3-chloro-5-ethoxy-4-propan-2-yloxyphenyl)methyl]-N-methylpropane-1,3-diamine
CC[C@@H](C(=O)N1CCN(c2ccccc2)CC1)n1ccc2cc(S(=O)(=O)N3CCCCC3)ccc21	(2S)-1-(4-phenylpiperazin-1-yl)-2-(5-piperidin-1-ylsulfonylindol-1-yl)butan-1-one
O=C(C1Cc2cc([N+](=O)[O-])ccc2N2CCN(c3ncccn3)CC12)N1CCOCC1	morpholin-4-yl-(8-nitro-3-pyrimidin-2-yl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-5-yl)methanone
CC(C)=CC(=O)O[C@H]1C[C@H]2C(C)=CC(=O)[C@H](C(C)C)[C@H]2/C=C(/C)[C@@]2(O)C=C[C@]1(C)O2	[(1S,2S,4R,8R,9S,10Z,12R)-12-hydroxy-1,5,11-trimethyl-7-oxo-8-propan-2-yl-15-oxatricyclo[10.2.1.04,9]pentadeca-5,10,13-trien-2-yl] 3-methylbut-2-enoate
CC.CC(C)c1c2c(cc3c1Sc1cc(C(C)C)c4c5ccccc5n5c4c1B3c1ccccc1-5)B1c3ccccc3-n3c4ccccc4c4c(C(C)C)cc(c1c43)O2.CC(C)c1c2c(cc3c1Sc1ccc4c5ccccc5n5c4c1B3c1ccccc1-5)B1c3ccccc3-n3c4ccccc4c4ccc(c1c43)O2.CC(C)c1ccc2c(c1)-n1c3ccccc3c3ccc4c(c31)B2c1cc2c(cc1N4c1ccccc1)Oc1ccc3c4ccccc4n4c3c1B2c1ccc(-c2ccccc2)cc1-4.c1ccc(-c2c3c(cc4c2Sc2cc(-c5ccccc5)c5c6ccccc6n6c5c2B4c2ccccc2-6)B2c4ccccc4-n4c5ccccc5c5c(-c6ccccc6)cc(c2c54)O3)cc1	9,27-diphenyl-41-propan-2-yl-23-oxa-12,27,38-triaza-1,5-diboratridecacyclo[29.13.2.219,22.02,26.04,24.05,21.06,11.012,20.013,18.028,45.032,37.038,46.039,44]octatetraconta-2,4(24),6(11),7,9,13,15,17,19,21,25,28(45),29,31(46),32,34,36,39(44),40,42,47-henicosaene;ethane;25-propan-2-yl-23-oxa-27-thia-12,38-diaza-1,5-diboratridecacyclo[29.13.2.219,22.02,26.04,24.05,21.06,11.012,20.013,18.028,45.032,37.038,46.039,44]octatetraconta-2(26),3,6,8,10,13,15,17,19,21,24,28(45),29,31(46),32,34,36,39,41,43,47-henicosaene;25,30,48-triphenyl-23-oxa-27-thia-12,38-diaza-1,5-diboratridecacyclo[29.13.2.219,22.02,26.04,24.05,21.06,11.012,20.013,18.028,45.032,37.038,46.039,44]octatetraconta-2(26),3,6,8,10,13,15,17,19,21,24,28(45),29,31(46),32,34,36,39,41,43,47-henicosaene;25,30,48-tri(propan-2-yl)-23-oxa-27-thia-12,38-diaza-1,5-diboratridecacyclo[29.13.2.219,22.02,26.04,24.05,21.06,11.012,20.013,18.028,45.032,37.038,46.039,44]octatetraconta-2(26),3,6,8,10,13,15,17,19,21,24,28(45),29,31(46),32,34,36,39,41,43,47-henicosaene
O=[N+]([O-])c1ccc(NCc2nccn2-c2ccccc2)cc1C(F)(F)F	4-nitro-N-[(1-phenylimidazol-2-yl)methyl]-3-(trifluoromethyl)aniline
Cc1sc2nc(CN3CCOCC3)nc(Sc3ncc(-c4ccccc4)n3C)c2c1C	4-[[5,6-dimethyl-4-(1-methyl-5-phenylimidazol-2-yl)sulfanylthieno[2,3-d]pyrimidin-2-yl]methyl]morpholine
CC(C)n1c(O)c(/C=C2\C=Nc3cnccc32)sc1=S	4-hydroxy-3-propan-2-yl-5-[(Z)-pyrrolo[2,3-c]pyridin-3-ylidenemethyl]-1,3-thiazole-2-thione
Cc1cc[n+](C2=C(c3c(-c4ccccc4)nn(C)c3[O-])C(=O)N(c3ccccc3F)C2=O)cc1C	4-[4-(3,4-dimethylpyridin-1-ium-1-yl)-1-(2-fluorophenyl)-2,5-dioxopyrrol-3-yl]-2-methyl-5-phenylpyrazol-3-olate
N#CC1=C(SCC(=O)Nc2ccc(Oc3ccccc3)cc2)NC(=O)CC1c1ccc(Cl)cc1	2-[[4-(4-chlorophenyl)-5-cyano-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(4-phenoxyphenyl)acetamide
COC(=O)c1cccc(NC(=S)Nc2ccc(F)cc2F)c1	methyl 3-[(2,4-difluorophenyl)carbamothioylamino]benzoate
CC(C)N(CCCl)C(=O)c1cscn1	N-(2-chloroethyl)-N-propan-2-yl-1,3-thiazole-4-carboxamide
CN(c1ccc(-n2c3c(c4ccccc42)C=CCCC3)cc1)c1cccc(-c2ccccc2)c1	N-[4-(7,8-dihydro-6H-cyclohepta[b]indol-5-yl)phenyl]-N-methyl-3-phenylaniline
CC(C)(C)[C@H]1COC(c2cc([N+](=O)[O-])ccc2P(c2ccccc2)c2ccccc2)=N1.CC(C)(C)[C@H]1COC(c2ccccc2P(C2CCCCC2)C2CCCCC2)=N1.CC(C)(C)[C@H]1COC(c2ccccc2P(c2ccc(F)cc2)c2ccc(F)cc2)=N1.Cc1ccc(P(c2ccc(C)cc2)c2ccccc2C2=N[C@@H](C(C)(C)C)CO2)cc1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C1=N[C@@H](C(C)(C)C)CO1	[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-4-nitrophenyl]-diphenylphosphane;[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]-bis(4-fluorophenyl)phosphane;[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]-bis(2-methylphenyl)phosphane;[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]-bis(4-methylphenyl)phosphane;[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]-dicyclohexylphosphane
CN(CCN1CCCc2c1nc(-c1ccccn1)[nH]c2=O)S(=O)(=O)c1ccccc1	N-methyl-N-[2-(4-oxo-2-pyridin-2-yl-3,5,6,7-tetrahydropyrido[2,3-d]pyrimidin-8-yl)ethyl]benzenesulfonamide
C=CCOc1cc(Br)c(C=c2sc3nc4ccccc4n3c2=O)cc1OC	2-[(2-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
CC(C)(S)C(=O)N[C@@H](CS)C(=O)O	(2R)-2-[(2-methyl-2-sulfanylpropanoyl)amino]-3-sulfanylpropanoic acid
Cl.Fc1ccc(C2CCCN2)cc1	2-(4-fluorophenyl)pyrrolidine;hydrochloride
COCC(NC(=O)c1cccc(-c2cc(CO)ccn2)c1)c1ccnn1C	3-[4-(hydroxymethyl)pyridin-2-yl]-N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]benzamide
COc1ccnc(C(=O)N[C@H]2CCO[C@H](Cc3ccc(F)cc3)[C@@H](Oc3ccccc3)[C@H](C)OC2=O)c1O	N-[(2R,3S,4S,7S)-2-[(4-fluorophenyl)methyl]-4-methyl-6-oxo-3-phenoxy-1,5-dioxonan-7-yl]-3-hydroxy-4-methoxypyridine-2-carboxamide
CCCC(=O)OC(C)C(N)C(=O)O	2-amino-3-butanoyloxybutanoic acid
C/C(=N\O)C(C)(C)NC[CH-]CNC(C)(C)/C(C)=N/O.[CH2-]C(C)(C)C.[Y]	(NE)-N-[3-[3-[[(3E)-3-hydroxyimino-2-methylbutan-2-yl]amino]propylamino]-3-methylbutan-2-ylidene]hydroxylamine;2-methanidyl-2-methylpropane;yttrium
CC(C)C(NC(=O)N(Cc1ccc(C(=O)NC[C@@H](O)C(=O)O)cc1)c1ccc(C2CCCCC2)cc1)c1ccc(OC(F)(F)F)cc1	(2R)-3-[[4-[[4-cyclohexyl-N-[[2-methyl-1-[4-(trifluoromethoxy)phenyl]propyl]carbamoyl]anilino]methyl]benzoyl]amino]-2-hydroxypropanoic acid
[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)C)cc(C(C)C)c3O)n4-c3ccc(-c4c(-c5ccccc5)cccc4C(C)(C)C)cc3C([2H])([2H])[2H])cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)C)cc(C(C)C)c3O)n4-c3ccc(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])cc3-c3ccccc3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)C)cc(C(C)C)c3O)n4-c3ccc(C([2H])([2H])[2H])cc3-c3ccccc3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[Pt].[Pt].[Pt]	2-[1-[4-(2-tert-butyl-6-phenylphenyl)-2-(trideuteriomethyl)phenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]pyridin-2-yl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]pyridin-2-yl]benzene-6-id-1-yl]-1-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]-2-phenylphenyl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]pyridin-2-yl]benzene-6-id-1-yl]-1-[2-phenyl-4-(trideuteriomethyl)phenyl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum
OB(O)c1ccc2cc3c(ccc4ccccc43)cc2c1	benzo[a]anthracen-9-ylboronic acid
O=C(NCc1c(-c2ccc3c(c2)OCO3)nc2c(Cl)cccn12)c1ccccc1	N-[[2-(1,3-benzodioxol-5-yl)-8-chloroimidazo[1,2-a]pyridin-3-yl]methyl]benzamide
COc1ccccc1C(Cn1c(=O)n(-c2cccc(C(=O)O)c2F)c(=O)c2c(C)c(-c3ncco3)sc21)OC1CCOCC1	2-fluoro-3-[1-[2-(2-methoxyphenyl)-2-(oxan-4-yloxy)ethyl]-5-methyl-6-(1,3-oxazol-2-yl)-2,4-dioxothieno[2,3-d]pyrimidin-3-yl]benzoic acid
CCCCc1ccc(N2C(=O)C(Nc3ccccc3CC)=C(Sc3ccccc3)C2=O)cc1	1-(4-butylphenyl)-3-(2-ethylanilino)-4-phenylsulfanylpyrrole-2,5-dione
CCc1cnccc1C(=O)N1CCOC[C@@H]1c1nc(C)no1	(3-ethylpyridin-4-yl)-[(3R)-3-(3-methyl-1,2,4-oxadiazol-5-yl)morpholin-4-yl]methanone
O=C(O)/C=C/c1cnc(N[C@@H]2CCN(CCc3ccc(Br)cc3)C2I)cn1	(E)-3-[5-[[(3R)-1-[2-(4-bromophenyl)ethyl]-2-iodopyrrolidin-3-yl]amino]pyrazin-2-yl]prop-2-enoic acid
N#Cc1ccc(Oc2ccc(F)cc2Cl)cc1Cl	2-chloro-4-(2-chloro-4-fluorophenoxy)benzonitrile
CCCCCCCCCCCC1=C(O)C(Nc2ccc(Cl)cc2Cl)=CC(=O)C1=O	5-(2,4-dichloroanilino)-4-hydroxy-3-undecylcyclohexa-3,5-diene-1,2-dione
C=C(C)C(=O)OCCCC(=O)OCCN(CCOC(=O)CCCOC(=O)C(=C)C)CCOC(=O)NCCOC(=O)C(=C)C	2-[2-[4-(2-methylprop-2-enoyloxy)butanoyloxy]ethyl-[2-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]ethyl]amino]ethyl 4-(2-methylprop-2-enoyloxy)butanoate
COc1ccc(S(=O)(=O)Nc2ccc(N3CCN(C)CC3)cc2)cc1N1CCCC1=O	4-methoxy-N-[4-(4-methylpiperazin-1-yl)phenyl]-3-(2-oxopyrrolidin-1-yl)benzenesulfonamide
[2H]C1([2H])N(C)C([2H])([2H])C([2H])([2H])N(c2ccc(C(=O)OC(C)(C)C)c(N(C(=O)C(F)(F)F)C3CCOCC3)c2)C1([2H])[2H]	tert-butyl 4-(2,2,3,3,5,5,6,6-octadeuterio-4-methylpiperazin-1-yl)-2-[oxan-4-yl-(2,2,2-trifluoroacetyl)amino]benzoate
Cl.O=C(NCCC1CCCNC1)C1Cc2ccccc2O1	N-(2-piperidin-3-ylethyl)-2,3-dihydro-1-benzofuran-2-carboxamide;hydrochloride
Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)O)cc12	1-(4-fluorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylic acid
C#CCCCCCCCCCCCCCCCC#C	nonadeca-1,18-diyne
NC(=O)c1ccc(C(F)(F)F)n(Cc2ccc(F)cc2Br)c1=O	1-[(2-bromo-4-fluorophenyl)methyl]-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide
CCCOc1ccc(-c2nc(C(=O)N3CCN(CCOC)CC3)cs2)c(Cl)c1	[2-(2-chloro-4-propoxyphenyl)-1,3-thiazol-4-yl]-[4-(2-methoxyethyl)piperazin-1-yl]methanone
CC(=O)N1CCN(CCNC(=O)c2cc3c(C)c(C)ccc3[nH]2)CC1	N-[2-(4-acetylpiperazin-1-yl)ethyl]-4,5-dimethyl-1H-indole-2-carboxamide
CC(S)C(=O)N1CCCCCCC1	1-(azocan-1-yl)-2-sulfanylpropan-1-one
Cl.Cl.NCC(NC(=O)CN(Cc1cccnc1)c1ccccc1)C1CC1	N-(2-amino-1-cyclopropylethyl)-2-[N-(pyridin-3-ylmethyl)anilino]acetamide;dihydrochloride
NC(=O)c1c(N)ncnc1N1CCC(c2nc(-c3ccnc(C4CC4)c3)cn2CCN2CCC2)CC1	4-amino-6-[4-[1-[2-(azetidin-1-yl)ethyl]-4-(2-cyclopropylpyridin-4-yl)imidazol-2-yl]piperidin-1-yl]pyrimidine-5-carboxamide
C=C(/C=C\N)SC(=C)/N=C\C	(1Z)-3-[1-[(Z)-ethylideneamino]ethenylsulfanyl]buta-1,3-dien-1-amine
COC(=O)c1cc(OC)c(OC(F)F)cc1NC(=O)CCN1CCSC1=O	methyl 4-(difluoromethoxy)-5-methoxy-2-[3-(2-oxo-1,3-thiazolidin-3-yl)propanoylamino]benzoate
O=C(c1ccc([N+](=O)[O-])cc1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	[(3S)-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-(4-nitrophenyl)methanone
N#Cc1cc(N)ccc1Oc1nc2ccccc2s1	5-amino-2-(1,3-benzothiazol-2-yloxy)benzonitrile
CCNc1ncc(F)cc1C(=O)NCc1cccc(Br)c1	N-[(3-bromophenyl)methyl]-2-(ethylamino)-5-fluoropyridine-3-carboxamide
CCCCOc1cccc(-n2cc(C(=O)N(CC)c3cc(F)cc(F)c3)c(=O)c3ccc(OCCCCCCCC[n+]4ccccc4)cc32)c1	1-(3-butoxyphenyl)-N-(3,5-difluorophenyl)-N-ethyl-4-oxo-7-(8-pyridin-1-ium-1-yloctoxy)quinoline-3-carboxamide
Cc1cc(C)c(C(=O)N/N=C/c2ccc([N+](=O)[O-])o2)[nH]1	3,5-dimethyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1H-pyrrole-2-carboxamide
CC(NC(=O)c1cc2ccccc2c(Cl)c1NC(=O)c1cc(C(F)(F)F)nn1-c1ncccc1Cl)C1CC1	N-[1-chloro-3-(1-cyclopropylethylcarbamoyl)naphthalen-2-yl]-2-(3-chloropyridin-2-yl)-5-(trifluoromethyl)pyrazole-3-carboxamide
N#Cc1ccc(N2C(=O)C(O)=C(C(=O)CCc3ccccc3)C2c2ccc(F)cc2)cc1	4-[2-(4-fluorophenyl)-4-hydroxy-5-oxo-3-(3-phenylpropanoyl)-2H-pyrrol-1-yl]benzonitrile
Cc1cc(C(=O)N2CCC3(CC2)CCN(C(=O)c2ccc(-c4ccc(Cl)cc4)o2)C3)cc(C)c1C(=O)O	4-[2-[5-(4-chlorophenyl)furan-2-carbonyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]-2,6-dimethylbenzoic acid
CCOC(=O)c1cnc(N2CCc3ccccc32)nc1OCc1cc(OC)ccc1OC	ethyl 2-(2,3-dihydroindol-1-yl)-4-[(2,5-dimethoxyphenyl)methoxy]pyrimidine-5-carboxylate
O=C(Cc1ccc(Cl)c(Cl)c1)NC1CCN(C(=O)c2ccco2)CC1	2-(3,4-dichlorophenyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]acetamide
C[C@H](NC(=O)c1cncs1)c1ccc(O[C@@H]2CCN(c3ccnc(Cl)n3)C2)cc1	N-[(1S)-1-[4-[(3R)-1-(2-chloropyrimidin-4-yl)pyrrolidin-3-yl]oxyphenyl]ethyl]-1,3-thiazole-5-carboxamide
Cc1nn(CC(C)C(=O)Nc2c(F)c(F)cc(F)c2F)c(C)c1Cl	3-(4-chloro-3,5-dimethylpyrazol-1-yl)-2-methyl-N-(2,3,5,6-tetrafluorophenyl)propanamide
FC(F)(F)c1cc(COc2ccc3c(c2)CCN3)ccc1C1CCCCC1	5-[[4-cyclohexyl-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-indole
N#Cc1ccc(-c2ccc(C(=O)NCCCCN3CCc4ccc(OS(=O)(=O)C(F)(F)F)cc4C3)cc2)cc1	[2-[4-[[4-(4-cyanophenyl)benzoyl]amino]butyl]-3,4-dihydro-1H-isoquinolin-7-yl] trifluoromethanesulfonate
c1ccc(-c2ccc3c(c2)C2(c4cc(N(c5ccc6ccccc6c5)c5cccc6ccccc56)ccc4-3)c3ccccc3-c3c2ccc2c3oc3ccccc32)cc1	N-naphthalen-1-yl-N-naphthalen-2-yl-7-phenylspiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-2-amine
COC(C(=O)Nc1ccc(/C=C/c2ccc(NS(=O)(=O)C3CC3)cc2S(=O)(=O)O)cc1)S(=O)(=O)O	5-(cyclopropylsulfonylamino)-2-[(E)-2-[4-[(2-methoxy-2-sulfoacetyl)amino]phenyl]ethenyl]benzenesulfonic acid
CCn1nnc2c(C)c([C@@H](CC(=O)O)c3ccc4c(c3)CN(C(=O)c3ccccc3)[C@@H](C)C4)ccc21	(3S)-3-[(3S)-2-benzoyl-3-methyl-3,4-dihydro-1H-isoquinolin-7-yl]-3-(1-ethyl-4-methylbenzotriazol-5-yl)propanoic acid
CC(=O)NCCCC1OCC(Oc2ccc(OC3CCCC3)cc2)CO1.CC(=O)NCCCC1OCC(Oc2ccc(OCc3ccccc3)cc2)CO1	N-[3-[5-(4-cyclopentyloxyphenoxy)-1,3-dioxan-2-yl]propyl]acetamide;N-[3-[5-(4-phenylmethoxyphenoxy)-1,3-dioxan-2-yl]propyl]acetamide
O=C(O)c1cccc(CN2C(=O)CCC2=O)c1	3-[(2,5-dioxopyrrolidin-1-yl)methyl]benzoic acid
C/C(=N\NC(=O)COc1cccc(Br)c1)c1ccccc1O	2-(3-bromophenoxy)-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]acetamide
CCc1ccc(C2C(C#N)=C(N)Oc3n[nH]c(-c4cccc([N+](=O)[O-])c4)c32)s1	6-amino-4-(5-ethylthiophen-2-yl)-3-(3-nitrophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
C/C(=C/C(=O)O)CNc1cccc(OC(F)(F)F)c1	(Z)-3-methyl-4-[3-(trifluoromethoxy)anilino]but-2-enoic acid
CCCCCCCCCONCCc1cn(OC(=O)C(=O)O)c2ccccc12	2-[3-[2-(nonoxyamino)ethyl]indol-1-yl]oxy-2-oxoacetic acid
Cc1cc(NC(=O)c2cc3ccccc3s2)nn1-c1ccccc1	N-(5-methyl-1-phenylpyrazol-3-yl)-1-benzothiophene-2-carboxamide
CN/C([S-])=N/N=C(C(/C)=N/N=C(\[S-])NC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)\c1c(F)c(F)c(F)c(F)c1F.[Cu+2]	copper;N-methyl-N'-[(E)-[(2E)-1-(2,3,4,5,6-pentafluorophenyl)-2-[(Z)-[sulfido-(triphenylphosphaniumylmethylamino)methylidene]hydrazinylidene]propylidene]amino]carbamimidothioate
CCN(CC)CCCC(C)NC(=O)c1csc(COC)n1	N-[5-(diethylamino)pentan-2-yl]-2-(methoxymethyl)-1,3-thiazole-4-carboxamide
CCN(C(=O)C1CCC(=O)N1)c1cc(O)ccc1C	N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide
CC(C)(C)c1ccc(CN2C[C@H](C(=O)O)CC2=O)cc1	(3R)-1-[(4-tert-butylphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid
COc1ccccc1CN(C)C(=O)c1cccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)c1	N-[(2-methoxyphenyl)methyl]-N-methyl-3-(4-phenylpiperazin-1-yl)sulfonylbenzamide
CCOC(=O)c1ccc(NC(=S)NCCN(C)C)c(C)c1	ethyl 4-[2-(dimethylamino)ethylcarbamothioylamino]-3-methylbenzoate
CC1CC2CCCC(NC(=O)c3onc(OCC(C)C(=O)NC(C)(C)C(=O)O)c3SC(C)C)C(C1)C2	2-methyl-2-[[2-methyl-3-[[5-[(8-methyl-2-bicyclo[4.3.1]decanyl)carbamoyl]-4-propan-2-ylsulfanyl-1,2-oxazol-3-yl]oxy]propanoyl]amino]propanoic acid
COc1ccc(CN2C(=O)C(=O)/C(=C(/O)c3ccc([N+](=O)[O-])cc3)C2c2c[nH]c3ccccc23)cc1	(4E)-4-[hydroxy-(4-nitrophenyl)methylidene]-5-(1H-indol-3-yl)-1-[(4-methoxyphenyl)methyl]pyrrolidine-2,3-dione
Cc1ccc(=O)n(CC(=O)N2CCO[C@@](C)(C(N)=O)C2)n1	(2R)-2-methyl-4-[2-(3-methyl-6-oxopyridazin-1-yl)acetyl]morpholine-2-carboxamide
CCCCN(C)C(=O)C1CCN(c2ccccc2C(=O)Nc2ccc3cn(C(=O)Cn4cccn4)cc3c2)CC1	N-butyl-N-methyl-1-[2-[[2-(2-pyrazol-1-ylacetyl)isoindol-5-yl]carbamoyl]phenyl]piperidine-4-carboxamide
C=C1CCC2C(C)Cc3ccc(OC)c(O)c3C2(CCC)C1.CC	ethane;3-methoxy-9-methyl-6-methylidene-4b-propyl-5,7,8,8a,9,10-hexahydrophenanthren-4-ol
CCc1nc(=O)oc2c(CCC(=O)OC)cccc12	methyl 3-(4-ethyl-2-oxo-1,3-benzoxazin-8-yl)propanoate
CNC(=O)c1cccc(NC(=O)CSc2nc(C)c(C)c(C)n2)c1	N-methyl-3-[[2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetyl]amino]benzamide
c1ccc(C2CC2)c(-c2cnc[nH]2)c1	5-(2-cyclopropylphenyl)-1H-imidazole
CCc1nc(SCC(=O)NC2COC3(CCCCC3)C2)n[nH]1	2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-oxaspiro[4.5]decan-3-yl)acetamide
COc1nc2c(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)c(F)cc(Cl)c2o1	3-(7-chloro-5-fluoro-2-methoxy-1,3-benzoxazol-4-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione
COCCCn1cncn1.COSOC	1-(3-methoxypropyl)-1,2,4-triazole;methoxysulfanyloxymethane
CCc1ccccc1N(CC(=O)N/N=C\c1cc(C)n(-c2cccc(C)c2)c1C)S(=O)(=O)c1ccccc1	2-[N-(benzenesulfonyl)-2-ethylanilino]-N-[(Z)-[2,5-dimethyl-1-(3-methylphenyl)pyrrol-3-yl]methylideneamino]acetamide
NN1CCCCC1c1ccccc1	2-phenylpiperidin-1-amine
CCCCCCCCCCCCCCCCCCCCC(O)(O)C(=O)O	2,2-dihydroxydocosanoic acid
CCNC(=O)CCC(=O)Nc1ccccc1Oc1cc(F)cc(F)c1	N'-[2-(3,5-difluorophenoxy)phenyl]-N-ethylbutanediamide
c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccc6oc(-c7ccccc7)cc6c5)c(-c5ccccc5)c4)c4ccccc34)cc2)cc1	2-phenyl-5-[2-phenyl-4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-1-benzofuran
CC(C)(C)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N[C@H]2c2ccccc21	(1R,8S,9S,13R)-11-tert-butyl-11,14-diazatetracyclo[6.5.1.02,7.09,13]tetradeca-2,4,6-triene-10,12-dione

C#CCCNc1cccc(CO)c1

[3-(but-3-ynylamino)phenyl]methanol

CSc1ccc(NCC(O)CN2CCc3ccccc3C2)nn1

1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(6-methylsulfanylpyridazin-3-yl)amino]propan-2-ol

CC(Oc1ccc(OCc2ccccc2)cc1)C(=O)[O-]

2-(4-phenylmethoxyphenoxy)propanoate

CCC(=O)N1CCn2cc(C(F)(F)F)nc2C1

1-[2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one

COc1ccc2ncc(N(C)C)c([C@@H](O)CCC3(C(=O)O)CCN(CCOc4c(F)cc(F)cc4F)CC3)c2c1

4-[(3S)-3-[3-(dimethylamino)-6-methoxyquinolin-4-yl]-3-hydroxypropyl]-1-[2-(2,4,6-trifluorophenoxy)ethyl]piperidine-4-carboxylic acid

CC(CO)NC(C)CCC(=O)O

4-(1-hydroxypropan-2-ylamino)pentanoic acid

CC(C)c1ccc(-c2nc3c(N)nc(N)nc3nc2N)cc1

6-(4-propan-2-ylphenyl)pteridine-2,4,7-triamine

CCOc1cc(CNCCCNC)cc(Cl)c1OC(C)C

N'-[(3-chloro-5-ethoxy-4-propan-2-yloxyphenyl)methyl]-N-methylpropane-1,3-diamine

CC[C@@H](C(=O)N1CCN(c2ccccc2)CC1)n1ccc2cc(S(=O)(=O)N3CCCCC3)ccc21

(2S)-1-(4-phenylpiperazin-1-yl)-2-(5-piperidin-1-ylsulfonylindol-1-yl)butan-1-one

O=C(C1Cc2cc([N+](=O)[O-])ccc2N2CCN(c3ncccn3)CC12)N1CCOCC1

morpholin-4-yl-(8-nitro-3-pyrimidin-2-yl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-5-yl)methanone

CC(C)=CC(=O)O[C@H]1C[C@H]2C(C)=CC(=O)[C@H](C(C)C)[C@H]2/C=C(/C)[C@@]2(O)C=C[C@]1(C)O2

[(1S,2S,4R,8R,9S,10Z,12R)-12-hydroxy-1,5,11-trimethyl-7-oxo-8-propan-2-yl-15-oxatricyclo[10.2.1.04,9]pentadeca-5,10,13-trien-2-yl] 3-methylbut-2-enoate

CC.CC(C)c1c2c(cc3c1Sc1cc(C(C)C)c4c5ccccc5n5c4c1B3c1ccccc1-5)B1c3ccccc3-n3c4ccccc4c4c(C(C)C)cc(c1c43)O2.CC(C)c1c2c(cc3c1Sc1ccc4c5ccccc5n5c4c1B3c1ccccc1-5)B1c3ccccc3-n3c4ccccc4c4ccc(c1c43)O2.CC(C)c1ccc2c(c1)-n1c3ccccc3c3ccc4c(c31)B2c1cc2c(cc1N4c1ccccc1)Oc1ccc3c4ccccc4n4c3c1B2c1ccc(-c2ccccc2)cc1-4.c1ccc(-c2c3c(cc4c2Sc2cc(-c5ccccc5)c5c6ccccc6n6c5c2B4c2ccccc2-6)B2c4ccccc4-n4c5ccccc5c5c(-c6ccccc6)cc(c2c54)O3)cc1

9,27-diphenyl-41-propan-2-yl-23-oxa-12,27,38-triaza-1,5-diboratridecacyclo[29.13.2.219,22.02,26.04,24.05,21.06,11.012,20.013,18.028,45.032,37.038,46.039,44]octatetraconta-2,4(24),6(11),7,9,13,15,17,19,21,25,28(45),29,31(46),32,34,36,39(44),40,42,47-henicosaene;ethane;25-propan-2-yl-23-oxa-27-thia-12,38-diaza-1,5-diboratridecacyclo[29.13.2.219,22.02,26.04,24.05,21.06,11.012,20.013,18.028,45.032,37.038,46.039,44]octatetraconta-2(26),3,6,8,10,13,15,17,19,21,24,28(45),29,31(46),32,34,36,39,41,43,47-henicosaene;25,30,48-triphenyl-23-oxa-27-thia-12,38-diaza-1,5-diboratridecacyclo[29.13.2.219,22.02,26.04,24.05,21.06,11.012,20.013,18.028,45.032,37.038,46.039,44]octatetraconta-2(26),3,6,8,10,13,15,17,19,21,24,28(45),29,31(46),32,34,36,39,41,43,47-henicosaene;25,30,48-tri(propan-2-yl)-23-oxa-27-thia-12,38-diaza-1,5-diboratridecacyclo[29.13.2.219,22.02,26.04,24.05,21.06,11.012,20.013,18.028,45.032,37.038,46.039,44]octatetraconta-2(26),3,6,8,10,13,15,17,19,21,24,28(45),29,31(46),32,34,36,39,41,43,47-henicosaene

O=[N+]([O-])c1ccc(NCc2nccn2-c2ccccc2)cc1C(F)(F)F

4-nitro-N-[(1-phenylimidazol-2-yl)methyl]-3-(trifluoromethyl)aniline

Cc1sc2nc(CN3CCOCC3)nc(Sc3ncc(-c4ccccc4)n3C)c2c1C

4-[[5,6-dimethyl-4-(1-methyl-5-phenylimidazol-2-yl)sulfanylthieno[2,3-d]pyrimidin-2-yl]methyl]morpholine

CC(C)n1c(O)c(/C=C2\C=Nc3cnccc32)sc1=S

4-hydroxy-3-propan-2-yl-5-[(Z)-pyrrolo[2,3-c]pyridin-3-ylidenemethyl]-1,3-thiazole-2-thione

Cc1cc[n+](C2=C(c3c(-c4ccccc4)nn(C)c3[O-])C(=O)N(c3ccccc3F)C2=O)cc1C

4-[4-(3,4-dimethylpyridin-1-ium-1-yl)-1-(2-fluorophenyl)-2,5-dioxopyrrol-3-yl]-2-methyl-5-phenylpyrazol-3-olate

N#CC1=C(SCC(=O)Nc2ccc(Oc3ccccc3)cc2)NC(=O)CC1c1ccc(Cl)cc1

2-[[4-(4-chlorophenyl)-5-cyano-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(4-phenoxyphenyl)acetamide

COC(=O)c1cccc(NC(=S)Nc2ccc(F)cc2F)c1

methyl 3-[(2,4-difluorophenyl)carbamothioylamino]benzoate

CC(C)N(CCCl)C(=O)c1cscn1

N-(2-chloroethyl)-N-propan-2-yl-1,3-thiazole-4-carboxamide

CN(c1ccc(-n2c3c(c4ccccc42)C=CCCC3)cc1)c1cccc(-c2ccccc2)c1

N-[4-(7,8-dihydro-6H-cyclohepta[b]indol-5-yl)phenyl]-N-methyl-3-phenylaniline

CC(C)(C)[C@H]1COC(c2cc([N+](=O)[O-])ccc2P(c2ccccc2)c2ccccc2)=N1.CC(C)(C)[C@H]1COC(c2ccccc2P(C2CCCCC2)C2CCCCC2)=N1.CC(C)(C)[C@H]1COC(c2ccccc2P(c2ccc(F)cc2)c2ccc(F)cc2)=N1.Cc1ccc(P(c2ccc(C)cc2)c2ccccc2C2=N[C@@H](C(C)(C)C)CO2)cc1.Cc1ccccc1P(c1ccccc1C)c1ccccc1C1=N[C@@H](C(C)(C)C)CO1

[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-4-nitrophenyl]-diphenylphosphane;[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]-bis(4-fluorophenyl)phosphane;[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]-bis(2-methylphenyl)phosphane;[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]-bis(4-methylphenyl)phosphane;[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]-dicyclohexylphosphane

CN(CCN1CCCc2c1nc(-c1ccccn1)[nH]c2=O)S(=O)(=O)c1ccccc1

N-methyl-N-[2-(4-oxo-2-pyridin-2-yl-3,5,6,7-tetrahydropyrido[2,3-d]pyrimidin-8-yl)ethyl]benzenesulfonamide

C=CCOc1cc(Br)c(C=c2sc3nc4ccccc4n3c2=O)cc1OC

2-[(2-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one

CC(C)(S)C(=O)N[C@@H](CS)C(=O)O

(2R)-2-[(2-methyl-2-sulfanylpropanoyl)amino]-3-sulfanylpropanoic acid

Cl.Fc1ccc(C2CCCN2)cc1

2-(4-fluorophenyl)pyrrolidine;hydrochloride

COCC(NC(=O)c1cccc(-c2cc(CO)ccn2)c1)c1ccnn1C

3-[4-(hydroxymethyl)pyridin-2-yl]-N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]benzamide

COc1ccnc(C(=O)N[C@H]2CCO[C@H](Cc3ccc(F)cc3)[C@@H](Oc3ccccc3)[C@H](C)OC2=O)c1O

N-[(2R,3S,4S,7S)-2-[(4-fluorophenyl)methyl]-4-methyl-6-oxo-3-phenoxy-1,5-dioxonan-7-yl]-3-hydroxy-4-methoxypyridine-2-carboxamide

CCCC(=O)OC(C)C(N)C(=O)O

2-amino-3-butanoyloxybutanoic acid

C/C(=N\O)C(C)(C)NC[CH-]CNC(C)(C)/C(C)=N/O.[CH2-]C(C)(C)C.[Y]

(NE)-N-[3-[3-[[(3E)-3-hydroxyimino-2-methylbutan-2-yl]amino]propylamino]-3-methylbutan-2-ylidene]hydroxylamine;2-methanidyl-2-methylpropane;yttrium

CC(C)C(NC(=O)N(Cc1ccc(C(=O)NC[C@@H](O)C(=O)O)cc1)c1ccc(C2CCCCC2)cc1)c1ccc(OC(F)(F)F)cc1

(2R)-3-[[4-[[4-cyclohexyl-N-[[2-methyl-1-[4-(trifluoromethoxy)phenyl]propyl]carbamoyl]anilino]methyl]benzoyl]amino]-2-hydroxypropanoic acid

[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)C)cc(C(C)C)c3O)n4-c3ccc(-c4c(-c5ccccc5)cccc4C(C)(C)C)cc3C([2H])([2H])[2H])cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)C)cc(C(C)C)c3O)n4-c3ccc(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])cc3-c3ccccc3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)C)cc(C(C)C)c3O)n4-c3ccc(C([2H])([2H])[2H])cc3-c3ccccc3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[Pt].[Pt].[Pt]

2-[1-[4-(2-tert-butyl-6-phenylphenyl)-2-(trideuteriomethyl)phenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]pyridin-2-yl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]pyridin-2-yl]benzene-6-id-1-yl]-1-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]-2-phenylphenyl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]pyridin-2-yl]benzene-6-id-1-yl]-1-[2-phenyl-4-(trideuteriomethyl)phenyl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum

OB(O)c1ccc2cc3c(ccc4ccccc43)cc2c1

benzo[a]anthracen-9-ylboronic acid

O=C(NCc1c(-c2ccc3c(c2)OCO3)nc2c(Cl)cccn12)c1ccccc1

N-[[2-(1,3-benzodioxol-5-yl)-8-chloroimidazo[1,2-a]pyridin-3-yl]methyl]benzamide

COc1ccccc1C(Cn1c(=O)n(-c2cccc(C(=O)O)c2F)c(=O)c2c(C)c(-c3ncco3)sc21)OC1CCOCC1

2-fluoro-3-[1-[2-(2-methoxyphenyl)-2-(oxan-4-yloxy)ethyl]-5-methyl-6-(1,3-oxazol-2-yl)-2,4-dioxothieno[2,3-d]pyrimidin-3-yl]benzoic acid

CCCCc1ccc(N2C(=O)C(Nc3ccccc3CC)=C(Sc3ccccc3)C2=O)cc1

1-(4-butylphenyl)-3-(2-ethylanilino)-4-phenylsulfanylpyrrole-2,5-dione

CCc1cnccc1C(=O)N1CCOC[C@@H]1c1nc(C)no1

(3-ethylpyridin-4-yl)-[(3R)-3-(3-methyl-1,2,4-oxadiazol-5-yl)morpholin-4-yl]methanone

O=C(O)/C=C/c1cnc(N[C@@H]2CCN(CCc3ccc(Br)cc3)C2I)cn1

(E)-3-[5-[[(3R)-1-[2-(4-bromophenyl)ethyl]-2-iodopyrrolidin-3-yl]amino]pyrazin-2-yl]prop-2-enoic acid

N#Cc1ccc(Oc2ccc(F)cc2Cl)cc1Cl

2-chloro-4-(2-chloro-4-fluorophenoxy)benzonitrile

CCCCCCCCCCCC1=C(O)C(Nc2ccc(Cl)cc2Cl)=CC(=O)C1=O

5-(2,4-dichloroanilino)-4-hydroxy-3-undecylcyclohexa-3,5-diene-1,2-dione

C=C(C)C(=O)OCCCC(=O)OCCN(CCOC(=O)CCCOC(=O)C(=C)C)CCOC(=O)NCCOC(=O)C(=C)C

2-[2-[4-(2-methylprop-2-enoyloxy)butanoyloxy]ethyl-[2-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]ethyl]amino]ethyl 4-(2-methylprop-2-enoyloxy)butanoate

COc1ccc(S(=O)(=O)Nc2ccc(N3CCN(C)CC3)cc2)cc1N1CCCC1=O

4-methoxy-N-[4-(4-methylpiperazin-1-yl)phenyl]-3-(2-oxopyrrolidin-1-yl)benzenesulfonamide

[2H]C1([2H])N(C)C([2H])([2H])C([2H])([2H])N(c2ccc(C(=O)OC(C)(C)C)c(N(C(=O)C(F)(F)F)C3CCOCC3)c2)C1([2H])[2H]

tert-butyl 4-(2,2,3,3,5,5,6,6-octadeuterio-4-methylpiperazin-1-yl)-2-[oxan-4-yl-(2,2,2-trifluoroacetyl)amino]benzoate

Cl.O=C(NCCC1CCCNC1)C1Cc2ccccc2O1

N-(2-piperidin-3-ylethyl)-2,3-dihydro-1-benzofuran-2-carboxamide;hydrochloride

Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)O)cc12

1-(4-fluorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylic acid

C#CCCCCCCCCCCCCCCCC#C

nonadeca-1,18-diyne

NC(=O)c1ccc(C(F)(F)F)n(Cc2ccc(F)cc2Br)c1=O

1-[(2-bromo-4-fluorophenyl)methyl]-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide

CCCOc1ccc(-c2nc(C(=O)N3CCN(CCOC)CC3)cs2)c(Cl)c1

[2-(2-chloro-4-propoxyphenyl)-1,3-thiazol-4-yl]-[4-(2-methoxyethyl)piperazin-1-yl]methanone

CC(=O)N1CCN(CCNC(=O)c2cc3c(C)c(C)ccc3[nH]2)CC1

N-[2-(4-acetylpiperazin-1-yl)ethyl]-4,5-dimethyl-1H-indole-2-carboxamide

CC(S)C(=O)N1CCCCCCC1

1-(azocan-1-yl)-2-sulfanylpropan-1-one

Cl.Cl.NCC(NC(=O)CN(Cc1cccnc1)c1ccccc1)C1CC1

N-(2-amino-1-cyclopropylethyl)-2-[N-(pyridin-3-ylmethyl)anilino]acetamide;dihydrochloride

NC(=O)c1c(N)ncnc1N1CCC(c2nc(-c3ccnc(C4CC4)c3)cn2CCN2CCC2)CC1

4-amino-6-[4-[1-[2-(azetidin-1-yl)ethyl]-4-(2-cyclopropylpyridin-4-yl)imidazol-2-yl]piperidin-1-yl]pyrimidine-5-carboxamide

C=C(/C=C\N)SC(=C)/N=C\C

(1Z)-3-[1-[(Z)-ethylideneamino]ethenylsulfanyl]buta-1,3-dien-1-amine

COC(=O)c1cc(OC)c(OC(F)F)cc1NC(=O)CCN1CCSC1=O

methyl 4-(difluoromethoxy)-5-methoxy-2-[3-(2-oxo-1,3-thiazolidin-3-yl)propanoylamino]benzoate

O=C(c1ccc([N+](=O)[O-])cc1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1

[(3S)-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-(4-nitrophenyl)methanone

N#Cc1cc(N)ccc1Oc1nc2ccccc2s1

5-amino-2-(1,3-benzothiazol-2-yloxy)benzonitrile

CCNc1ncc(F)cc1C(=O)NCc1cccc(Br)c1

N-[(3-bromophenyl)methyl]-2-(ethylamino)-5-fluoropyridine-3-carboxamide

CCCCOc1cccc(-n2cc(C(=O)N(CC)c3cc(F)cc(F)c3)c(=O)c3ccc(OCCCCCCCC[n+]4ccccc4)cc32)c1

1-(3-butoxyphenyl)-N-(3,5-difluorophenyl)-N-ethyl-4-oxo-7-(8-pyridin-1-ium-1-yloctoxy)quinoline-3-carboxamide

Cc1cc(C)c(C(=O)N/N=C/c2ccc([N+](=O)[O-])o2)[nH]1

3,5-dimethyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1H-pyrrole-2-carboxamide

CC(NC(=O)c1cc2ccccc2c(Cl)c1NC(=O)c1cc(C(F)(F)F)nn1-c1ncccc1Cl)C1CC1

N-[1-chloro-3-(1-cyclopropylethylcarbamoyl)naphthalen-2-yl]-2-(3-chloropyridin-2-yl)-5-(trifluoromethyl)pyrazole-3-carboxamide

N#Cc1ccc(N2C(=O)C(O)=C(C(=O)CCc3ccccc3)C2c2ccc(F)cc2)cc1

4-[2-(4-fluorophenyl)-4-hydroxy-5-oxo-3-(3-phenylpropanoyl)-2H-pyrrol-1-yl]benzonitrile

Cc1cc(C(=O)N2CCC3(CC2)CCN(C(=O)c2ccc(-c4ccc(Cl)cc4)o2)C3)cc(C)c1C(=O)O

4-[2-[5-(4-chlorophenyl)furan-2-carbonyl]-2,8-diazaspiro[4.5]decane-8-carbonyl]-2,6-dimethylbenzoic acid

CCOC(=O)c1cnc(N2CCc3ccccc32)nc1OCc1cc(OC)ccc1OC

ethyl 2-(2,3-dihydroindol-1-yl)-4-[(2,5-dimethoxyphenyl)methoxy]pyrimidine-5-carboxylate

O=C(Cc1ccc(Cl)c(Cl)c1)NC1CCN(C(=O)c2ccco2)CC1

2-(3,4-dichlorophenyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]acetamide

C[C@H](NC(=O)c1cncs1)c1ccc(O[C@@H]2CCN(c3ccnc(Cl)n3)C2)cc1

N-[(1S)-1-[4-[(3R)-1-(2-chloropyrimidin-4-yl)pyrrolidin-3-yl]oxyphenyl]ethyl]-1,3-thiazole-5-carboxamide

Cc1nn(CC(C)C(=O)Nc2c(F)c(F)cc(F)c2F)c(C)c1Cl

3-(4-chloro-3,5-dimethylpyrazol-1-yl)-2-methyl-N-(2,3,5,6-tetrafluorophenyl)propanamide

FC(F)(F)c1cc(COc2ccc3c(c2)CCN3)ccc1C1CCCCC1

5-[[4-cyclohexyl-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-indole

N#Cc1ccc(-c2ccc(C(=O)NCCCCN3CCc4ccc(OS(=O)(=O)C(F)(F)F)cc4C3)cc2)cc1

[2-[4-[[4-(4-cyanophenyl)benzoyl]amino]butyl]-3,4-dihydro-1H-isoquinolin-7-yl] trifluoromethanesulfonate

c1ccc(-c2ccc3c(c2)C2(c4cc(N(c5ccc6ccccc6c5)c5cccc6ccccc56)ccc4-3)c3ccccc3-c3c2ccc2c3oc3ccccc32)cc1

N-naphthalen-1-yl-N-naphthalen-2-yl-7-phenylspiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-2-amine

COC(C(=O)Nc1ccc(/C=C/c2ccc(NS(=O)(=O)C3CC3)cc2S(=O)(=O)O)cc1)S(=O)(=O)O

5-(cyclopropylsulfonylamino)-2-[(E)-2-[4-[(2-methoxy-2-sulfoacetyl)amino]phenyl]ethenyl]benzenesulfonic acid

CCn1nnc2c(C)c([C@@H](CC(=O)O)c3ccc4c(c3)CN(C(=O)c3ccccc3)[C@@H](C)C4)ccc21

(3S)-3-[(3S)-2-benzoyl-3-methyl-3,4-dihydro-1H-isoquinolin-7-yl]-3-(1-ethyl-4-methylbenzotriazol-5-yl)propanoic acid

CC(=O)NCCCC1OCC(Oc2ccc(OC3CCCC3)cc2)CO1.CC(=O)NCCCC1OCC(Oc2ccc(OCc3ccccc3)cc2)CO1

N-[3-[5-(4-cyclopentyloxyphenoxy)-1,3-dioxan-2-yl]propyl]acetamide;N-[3-[5-(4-phenylmethoxyphenoxy)-1,3-dioxan-2-yl]propyl]acetamide

O=C(O)c1cccc(CN2C(=O)CCC2=O)c1

3-[(2,5-dioxopyrrolidin-1-yl)methyl]benzoic acid

C/C(=N\NC(=O)COc1cccc(Br)c1)c1ccccc1O

2-(3-bromophenoxy)-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]acetamide

CCc1ccc(C2C(C#N)=C(N)Oc3n[nH]c(-c4cccc([N+](=O)[O-])c4)c32)s1

6-amino-4-(5-ethylthiophen-2-yl)-3-(3-nitrophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

C/C(=C/C(=O)O)CNc1cccc(OC(F)(F)F)c1

(Z)-3-methyl-4-[3-(trifluoromethoxy)anilino]but-2-enoic acid

CCCCCCCCCONCCc1cn(OC(=O)C(=O)O)c2ccccc12

2-[3-[2-(nonoxyamino)ethyl]indol-1-yl]oxy-2-oxoacetic acid

Cc1cc(NC(=O)c2cc3ccccc3s2)nn1-c1ccccc1

N-(5-methyl-1-phenylpyrazol-3-yl)-1-benzothiophene-2-carboxamide

CN/C([S-])=N/N=C(C(/C)=N/N=C(\[S-])NC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)\c1c(F)c(F)c(F)c(F)c1F.[Cu+2]

copper;N-methyl-N'-[(E)-[(2E)-1-(2,3,4,5,6-pentafluorophenyl)-2-[(Z)-[sulfido-(triphenylphosphaniumylmethylamino)methylidene]hydrazinylidene]propylidene]amino]carbamimidothioate

CCN(CC)CCCC(C)NC(=O)c1csc(COC)n1

N-[5-(diethylamino)pentan-2-yl]-2-(methoxymethyl)-1,3-thiazole-4-carboxamide

CCN(C(=O)C1CCC(=O)N1)c1cc(O)ccc1C

N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-oxopyrrolidine-2-carboxamide

CC(C)(C)c1ccc(CN2C[C@H](C(=O)O)CC2=O)cc1

(3R)-1-[(4-tert-butylphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid

COc1ccccc1CN(C)C(=O)c1cccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)c1

N-[(2-methoxyphenyl)methyl]-N-methyl-3-(4-phenylpiperazin-1-yl)sulfonylbenzamide

CCOC(=O)c1ccc(NC(=S)NCCN(C)C)c(C)c1

ethyl 4-[2-(dimethylamino)ethylcarbamothioylamino]-3-methylbenzoate

CC1CC2CCCC(NC(=O)c3onc(OCC(C)C(=O)NC(C)(C)C(=O)O)c3SC(C)C)C(C1)C2

2-methyl-2-[[2-methyl-3-[[5-[(8-methyl-2-bicyclo[4.3.1]decanyl)carbamoyl]-4-propan-2-ylsulfanyl-1,2-oxazol-3-yl]oxy]propanoyl]amino]propanoic acid

COc1ccc(CN2C(=O)C(=O)/C(=C(/O)c3ccc([N+](=O)[O-])cc3)C2c2c[nH]c3ccccc23)cc1

(4E)-4-[hydroxy-(4-nitrophenyl)methylidene]-5-(1H-indol-3-yl)-1-[(4-methoxyphenyl)methyl]pyrrolidine-2,3-dione

Cc1ccc(=O)n(CC(=O)N2CCO[C@@](C)(C(N)=O)C2)n1

(2R)-2-methyl-4-[2-(3-methyl-6-oxopyridazin-1-yl)acetyl]morpholine-2-carboxamide

CCCCN(C)C(=O)C1CCN(c2ccccc2C(=O)Nc2ccc3cn(C(=O)Cn4cccn4)cc3c2)CC1

N-butyl-N-methyl-1-[2-[[2-(2-pyrazol-1-ylacetyl)isoindol-5-yl]carbamoyl]phenyl]piperidine-4-carboxamide

C=C1CCC2C(C)Cc3ccc(OC)c(O)c3C2(CCC)C1.CC

ethane;3-methoxy-9-methyl-6-methylidene-4b-propyl-5,7,8,8a,9,10-hexahydrophenanthren-4-ol

CCc1nc(=O)oc2c(CCC(=O)OC)cccc12

methyl 3-(4-ethyl-2-oxo-1,3-benzoxazin-8-yl)propanoate

CNC(=O)c1cccc(NC(=O)CSc2nc(C)c(C)c(C)n2)c1

N-methyl-3-[[2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetyl]amino]benzamide

c1ccc(C2CC2)c(-c2cnc[nH]2)c1

5-(2-cyclopropylphenyl)-1H-imidazole

CCc1nc(SCC(=O)NC2COC3(CCCCC3)C2)n[nH]1

2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-oxaspiro[4.5]decan-3-yl)acetamide

COc1nc2c(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)c(F)cc(Cl)c2o1

3-(7-chloro-5-fluoro-2-methoxy-1,3-benzoxazol-4-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione

COCCCn1cncn1.COSOC

1-(3-methoxypropyl)-1,2,4-triazole;methoxysulfanyloxymethane

CCc1ccccc1N(CC(=O)N/N=C\c1cc(C)n(-c2cccc(C)c2)c1C)S(=O)(=O)c1ccccc1

2-[N-(benzenesulfonyl)-2-ethylanilino]-N-[(Z)-[2,5-dimethyl-1-(3-methylphenyl)pyrrol-3-yl]methylideneamino]acetamide

NN1CCCCC1c1ccccc1

2-phenylpiperidin-1-amine

CCCCCCCCCCCCCCCCCCCCC(O)(O)C(=O)O

2,2-dihydroxydocosanoic acid

CCNC(=O)CCC(=O)Nc1ccccc1Oc1cc(F)cc(F)c1

N'-[2-(3,5-difluorophenoxy)phenyl]-N-ethylbutanediamide

c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccc6oc(-c7ccccc7)cc6c5)c(-c5ccccc5)c4)c4ccccc34)cc2)cc1

2-phenyl-5-[2-phenyl-4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-1-benzofuran

CC(C)(C)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N[C@H]2c2ccccc21

(1R,8S,9S,13R)-11-tert-butyl-11,14-diazatetracyclo[6.5.1.02,7.09,13]tetradeca-2,4,6-triene-10,12-dione