AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-21

SMILES stringlengths 2 756	IUPAC stringlengths 6 1.26k
CCC1(C)NC(=O)N(NC(=O)CN2CCN(Cc3ccccc3F)CC2)C1=O	N-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]acetamide
COC(=O)NC(C)(C)Nc1nccc(-c2cn(C(C)C)nc2-c2cc(Cl)cc(NS(C)(=O)=O)c2Cl)n1	methyl N-[2-[[4-[3-[2,5-dichloro-3-(methanesulfonamido)phenyl]-1-propan-2-ylpyrazol-4-yl]pyrimidin-2-yl]amino]propan-2-yl]carbamate
C=CCNC(=O)C1CC(c2cccc(C)c2)CN(C(=O)Nc2cccc(OC)c2)C1	1-N-(3-methoxyphenyl)-5-(3-methylphenyl)-3-N-prop-2-enylpiperidine-1,3-dicarboxamide
COc1ccc(-c2noc(CN(C(=O)C(C)C)C(C)C)n2)cc1	N-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methyl-N-propan-2-ylpropanamide
Cc1nc2c3cc(F)c(C)cc3nc(N3CCNCC3)n2n1.Cl	9-fluoro-2,8-dimethyl-5-piperazin-1-yl-[1,2,4]triazolo[1,5-c]quinazoline;hydrochloride
Cc1cc(-c2sc(Nc3ccncc3)nc2-c2cccc(C#N)c2)ncn1	3-[5-(6-methylpyrimidin-4-yl)-2-(pyridin-4-ylamino)-1,3-thiazol-4-yl]benzonitrile
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(N3CCC(Cc4ccccc4)CC3)c(C(=O)O)c2)cc1.O=C(O)C(F)(F)F	5-[(4-acetylphenyl)sulfonylamino]-2-(4-benzylpiperidin-1-yl)benzoic acid;2,2,2-trifluoroacetic acid
C=COc1ccc(C(CCCC(c2cc(C)c(OC=C)c(C)c2)c2cc(C)c(OC=C)cc2C)c2cc(C)c(OC=C)c(C)c2)cc1C	1-[1,5-bis(4-ethenoxy-3,5-dimethylphenyl)-5-(4-ethenoxy-3-methylphenyl)pentyl]-4-ethenoxy-2,5-dimethylbenzene
Cc1csc(CC2(N)CCC(Oc3ccc4c(c3)CCC(c3ccccc3)O4)CC2)n1	1-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-[(2-phenyl-3,4-dihydro-2H-chromen-6-yl)oxy]cyclohexan-1-amine
O=CN(CC1Sc2ccccc2NC1=O)OCc1ccccc1	N-[(3-oxo-4H-1,4-benzothiazin-2-yl)methyl]-N-phenylmethoxyformamide
C[C@@H]1CC(F)(F)CN1C(=O)OC(C)(C)C.C[C@@H]1CCc2ccccc2C1.NC(=O)c1cn[nH]c1N	5-amino-1H-pyrazole-4-carboxamide;tert-butyl (2R)-4,4-difluoro-2-methylpyrrolidine-1-carboxylate;(2R)-2-methyl-1,2,3,4-tetrahydronaphthalene
O=S(=O)(F)N1CCC(Nc2nc3ccccc3s2)CC1	4-(1,3-benzothiazol-2-ylamino)piperidine-1-sulfonyl fluoride
CC(C)CCOc1cccc(CCNC(=O)[C@H]2CCC(=O)NC(=O)N2)c1	(4R)-N-[2-[3-(3-methylbutoxy)phenyl]ethyl]-2,7-dioxo-1,3-diazepane-4-carboxamide
Cc1ccc(CC2=N[C@@H](C(=O)O)C(C)(C)S2)c(O)c1	(4S)-2-[(2-hydroxy-4-methylphenyl)methyl]-5,5-dimethyl-4H-1,3-thiazole-4-carboxylic acid
COc1ccc(C(C)NCc2cccc(O)c2)cc1F	3-[[1-(3-fluoro-4-methoxyphenyl)ethylamino]methyl]phenol
Nc1ccc(Cl)cc1C(=O)OCC(=O)c1c(-c2ccccc2)[nH]c2ccccc12	[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl] 2-amino-5-chlorobenzoate
C[C@H]1CCN2C(=O)[C@@H](NC(=O)NC3([C@H]4CN(C)CCS4(=O)=O)CCCCC3)CCCCCCCCCC[C@@H](C(=O)C(=O)NC3CC3)NC(=O)[C@H]12	N-cyclopropyl-2-[(3S,14S,17S,18S)-18-methyl-3-[[1-[(2R)-4-methyl-1,1-dioxo-1,4-thiazinan-2-yl]cyclohexyl]carbamoylamino]-2,16-dioxo-1,15-diazabicyclo[15.3.0]icosan-14-yl]-2-oxoacetamide
CN(C(=O)c1ccc(OCCCCC(=O)OCc2ccccc2)cc1C=O)C1CCC(=O)NC1=O	benzyl 5-[4-[(2,6-dioxopiperidin-3-yl)-methylcarbamoyl]-3-formylphenoxy]pentanoate
CCC1CCC(=O)OC1	5-ethyloxan-2-one
C/C1=C\CC[C@]2(C)O[C@H]2C[C@]2(C(C)C)CC[C@@](C)(O2)[C@H](O)CC1=O	(1S,3S,5S,8E,12R,13R)-12-hydroxy-5,9,13-trimethyl-1-propan-2-yl-4,16-dioxatricyclo[11.2.1.03,5]hexadec-8-en-10-one
CNC(=O)C1COCCN1C(=O)C1(N)CCCC(C)C1	4-(1-amino-3-methylcyclohexanecarbonyl)-N-methylmorpholine-3-carboxamide
Cc1cc(C)c2c(=O)cc(C(=O)Nc3ccc(S(=O)(=O)N4C[C@@H](C)O[C@@H](C)C4)cc3)oc2c1	N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide
CCN(C(=O)c1cc(F)c(N)c(F)c1)C(C)CN(C)C	4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3,5-difluorobenzamide
N=Nc1ncc(S(=O)(=O)O)s1	2-diazenyl-1,3-thiazole-5-sulfonic acid
NC(=O)Nc1ccc(NCc2csnn2)cc1	[4-(thiadiazol-4-ylmethylamino)phenyl]urea
COC(=O)C(=C/C(Cl)=C/N(C)C)C(=O)OC.COC(=O)c1cc(Cl)cn(Cc2ccc(Cl)nc2)c1=O.COC(=O)c1cc(Cl)cn(Cc2ccc(Cl)nc2)c1=O.COc1ccnc(NCCCCCN)n1.COc1ccnc(NCCCCCNC(=O)c2cc(Cl)cn(Cc3ccc(Cl)nc3)c2=O)n1.NCc1ccc(Cl)nc1	5-chloro-1-[(6-chloropyridin-3-yl)methyl]-N-[5-[(4-methoxypyrimidin-2-yl)amino]pentyl]-2-oxopyridine-3-carboxamide;(6-chloropyridin-3-yl)methanamine;dimethyl 2-[(Z)-2-chloro-3-(dimethylamino)prop-2-enylidene]propanedioate;N'-(4-methoxypyrimidin-2-yl)pentane-1,5-diamine;methyl 5-chloro-1-[(6-chloropyridin-3-yl)methyl]-2-oxopyridine-3-carboxylate
CN(C)C(=O)NCCNCc1cc(Cl)cc(Cl)c1O	3-[2-[(3,5-dichloro-2-hydroxyphenyl)methylamino]ethyl]-1,1-dimethylurea
CCN.CCNC1CCN(C(=O)OC(C)(C)C)CC1	tert-butyl 4-(ethylamino)piperidine-1-carboxylate;ethanamine
C=CCCC(=O)OC[C@H](NC(=O)[C@@H]1[C@@H]2CC[C@]3(O2)[C@H](C(=O)N(CC=C)c2c(C)cccc2Cl)N([C@@H](CC)CO)C(=O)[C@@H]13)c1ccccc1	[(2R)-2-[[(1R,2R,5S,6S,7S)-2-[(2-chloro-6-methylphenyl)-prop-2-enylcarbamoyl]-3-[(2S)-1-hydroxybutan-2-yl]-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]decane-6-carbonyl]amino]-2-phenylethyl] pent-4-enoate
COC(=O)/C=C/c1cccc(N(Cc2ccc(-c3ccc(OC)c(C)c3)cc2)C(=O)C2CCN(C(C)=O)CC2)c1	methyl (E)-3-[3-[(1-acetylpiperidine-4-carbonyl)-[[4-(4-methoxy-3-methylphenyl)phenyl]methyl]amino]phenyl]prop-2-enoate
CCC(NS(=O)(=O)CC)N(C)C	N-[1-(dimethylamino)propyl]ethanesulfonamide
CNCc1cc(-c2c(F)cccc2F)n(S(=O)(=O)c2cccnc2)c1Cl.O=C(O)/C=C/C(=O)O	(E)-but-2-enedioic acid;1-[2-chloro-5-(2,6-difluorophenyl)-1-pyridin-3-ylsulfonylpyrrol-3-yl]-N-methylmethanamine
CCCC(=O)O[C@]1(C(=O)COC(C)=O)CC[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C	[(6S,8S,9R,10S,11S,13S,14S,17R)-17-(2-acetyloxyacetyl)-6,9-difluoro-11-hydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] butanoate
CC(C)(C)CC(=O)Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6ccc(Cl)s6)cncc5[nH]4)c3n2)c1	N-[5-[3-[7-(5-chlorothiophen-2-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-pyrazolo[4,3-b]pyridin-5-yl]pyridin-3-yl]-3,3-dimethylbutanamide
C=C/C(=C\C=C(/C)C(=C)N1CCCc2ccccc21)C(=C)Cc1ccccc1CCCC	1-[(3E,5E)-7-[(2-butylphenyl)methyl]-6-ethenyl-3-methylocta-1,3,5,7-tetraen-2-yl]-3,4-dihydro-2H-quinoline
CCCN1C[C@H](NS(=O)(=O)c2c(C)cc(C)c3nonc23)CC1=O	5,7-dimethyl-N-[(3R)-5-oxo-1-propylpyrrolidin-3-yl]-2,1,3-benzoxadiazole-4-sulfonamide
CCCCCCCCCC/C=C\CCCCCCCCCCCCCCCCCC(=O)NC(COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)C(O)/C=C/CC/C=C/CCCCCCCCCCCCCC	(Z)-N-[(4E,8E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxytricosa-4,8-dien-2-yl]triacont-19-enamide
COc1ccccc1CN(C)c1nc(N2CCOCC2)nc(-n2c(C(F)F)nc3ccccc32)n1	4-[2-(difluoromethyl)benzimidazol-1-yl]-N-[(2-methoxyphenyl)methyl]-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
N#Cc1nc(-n2ccnc2)ccc1N	3-amino-6-imidazol-1-ylpyridine-2-carbonitrile
CNCC(=O)c1cc(C)n(C(C)C)c1C	1-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-(methylamino)ethanone
COCC1CCCCCCCCC1	methoxymethylcyclodecane
CC(C)(C)OC(=O)NCCC(=O)NCCCN1CCCCCC1	tert-butyl N-[3-[3-(azepan-1-yl)propylamino]-3-oxopropyl]carbamate
O=C1CCC(N2C(=O)c3ccc(CNC4C[C@H]5CNC[C@@H](C4)C5)cc3C2=O)C(=O)N1	5-[[[(1R,5S)-3-azabicyclo[3.3.1]nonan-7-yl]amino]methyl]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
CCCC(=O)Oc1ccc(OC(F)F)c([N+](=O)[O-])c1	[4-(difluoromethoxy)-3-nitrophenyl] butanoate
[C-]#[N+]C1=C(O)[C@H](C)[C@H]2CCc3c(OC4CCCC4)nc(-c4ccnc5c(F)cccc45)nc3[C@]2(C)C1	(6aR,7R,10aR)-4-cyclopentyloxy-2-(8-fluoroquinolin-4-yl)-9-isocyano-7,10a-dimethyl-6,6a,7,10-tetrahydro-5H-benzo[h]quinazolin-8-ol
CCC(C)(C)OCCc1cccc(C(=O)O)c1	3-[2-(2-methylbutan-2-yloxy)ethyl]benzoic acid
NCC1CCCC2(CCOCC2)O1	1,9-dioxaspiro[5.5]undecan-2-ylmethanamine
CC(C)OC(=O)c1ccc(Cl)c(-c2ccccc2)n1.CC(C)OC(=O)c1ccc(F)c(-c2ccccc2)n1.C[N+](C)(C)C.Cc1ccc(C(=O)OC(C)C)nc1-c1ccccc1.F.O=C(O)c1ccc(F)c(-c2ccccc2)n1	5-fluoro-6-phenylpyridine-2-carboxylic acid;propan-2-yl 5-chloro-6-phenylpyridine-2-carboxylate;propan-2-yl 5-fluoro-6-phenylpyridine-2-carboxylate;propan-2-yl 5-methyl-6-phenylpyridine-2-carboxylate;tetramethylazanium;hydrofluoride
CC(C)Cn1nc(C(=O)Nc2ncc(Cc3ccccc3)s2)c2ccccc2c1=O	N-(5-benzyl-1,3-thiazol-2-yl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide
Cc1ccc(-c2cc(C(F)F)n3ncc(C(=O)Nc4ccc(Br)cc4F)c3n2)cc1	N-(4-bromo-2-fluorophenyl)-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Cc1nn(C)c(C)c1-c1c(Cl)ccc2c(CCCOc3cccc4cc(F)ccc34)c(C(=O)OCCN3CCOCC3)n(CCN3CCN(C(=O)COc4cccc5c4CN(C4CCC(=O)NC4=O)C5=O)CC3)c12	2-morpholin-4-ylethyl 6-chloro-1-[2-[4-[2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-4-yl]oxy]acetyl]piperazin-1-yl]ethyl]-3-[3-(6-fluoronaphthalen-1-yl)oxypropyl]-7-(1,3,5-trimethylpyrazol-4-yl)indole-2-carboxylate
Cc1ccsc1/C=N\NC(=O)COc1ccc(C(C)(C)C)cc1Br	2-(2-bromo-4-tert-butylphenoxy)-N-[(Z)-(3-methylthiophen-2-yl)methylideneamino]acetamide
CCNC(=NCc1ccc(OC)c(OC)c1)NCc1ccc(CC)s1	2-[(3,4-dimethoxyphenyl)methyl]-1-ethyl-3-[(5-ethylthiophen-2-yl)methyl]guanidine
COc1ccc2cc3c(Nc4cc(F)ccc4F)[nH][nH]c-3c2c1	N-(2,5-difluorophenyl)-7-methoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CSC(SC)=C(C#N)C(=O)c1ccc(OC(F)(F)F)cc1	3,3-bis(methylsulfanyl)-2-[4-(trifluoromethoxy)benzoyl]prop-2-enenitrile
Br[Al](Br)Br.Br[Al](Br)Br.CC(=O)Br	acetyl bromide;tribromoalumane
CN(C)CCNC(=S)NCc1cccc(Cl)c1	1-[(3-chlorophenyl)methyl]-3-[2-(dimethylamino)ethyl]thiourea
Cc1cnc(C)n2nc(C=Cc3nc(N4CCC[C@@H]4C(F)(F)F)nn3C)nc12	5,8-dimethyl-2-[2-[2-methyl-5-[(2R)-2-(trifluoromethyl)pyrrolidin-1-yl]-1,2,4-triazol-3-yl]ethenyl]-[1,2,4]triazolo[1,5-c]pyrimidine
CC1CCC(NC(=O)CC2CCC(N)CC2)CC1	2-(4-aminocyclohexyl)-N-(4-methylcyclohexyl)acetamide
O=C(Nc1ccc(OCC2CC2)cc1)C1CSCN1	N-[4-(cyclopropylmethoxy)phenyl]-1,3-thiazolidine-4-carboxamide
CCCCOc1ccc(-c2ccc(Cl)c(/C=C/C(=O)Nc3ccc(S)cc3)c2)cc1	(E)-3-[5-(4-butoxyphenyl)-2-chlorophenyl]-N-(4-sulfanylphenyl)prop-2-enamide
CCOc1ccc(CNC(=O)CCn2cnc3onc(-c4ccccc4)c3c2=O)cc1	N-[(4-ethoxyphenyl)methyl]-3-(4-oxo-3-phenyl-[1,2]oxazolo[5,4-d]pyrimidin-5-yl)propanamide
CCC(C)NC(N)=NCCCOc1ccc(Cl)cc1C.I	1-butan-2-yl-2-[3-(4-chloro-2-methylphenoxy)propyl]guanidine;hydroiodide
C=CCn1c(SCC(=O)c2cc(C)n(CC=C)c2C)nnc1-c1ccncc1	1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
C/C=C(I)\C=C\N=C(C)C=N	2-N-[(1E,3E)-3-iodopenta-1,3-dienyl]propane-1,2-diimine
Cc1cc(-c2nc(-c3cc(C)c(OC[C@@H](O)CC(O)C(N)=O)c(C)c3)no2)cc(Cl)n1	(4S)-5-[4-[5-(2-chloro-6-methylpyridin-4-yl)-1,2,4-oxadiazol-3-yl]-2,6-dimethylphenoxy]-2,4-dihydroxypentanamide
COc1ccc(Cl)cc1NC(=O)CSc1ccc(-c2ccccc2)nn1	N-(5-chloro-2-methoxyphenyl)-2-(6-phenylpyridazin-3-yl)sulfanylacetamide
Cc1nc2sc3c(N4CCCC4)ncnc3c2c(C)c1Cl.Cl	12-chloro-11,13-dimethyl-6-pyrrolidin-1-yl-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;hydrochloride
Cc1ccc(C)c2c1C(=O)c1c(NCCN(C)C)ccc(NCCN(C)C)c1C2=O	1,4-bis[2-(dimethylamino)ethylamino]-5,8-dimethylanthracene-9,10-dione
CCCCCCOC(=O)Nc1ccc(Cc2ccc(NC(=O)OC)cc2)cc1	methyl N-[4-[[4-(hexoxycarbonylamino)phenyl]methyl]phenyl]carbamate
Cc1csc(NC(=O)C(S)Cc2ccccc2)n1	N-(4-methyl-1,3-thiazol-2-yl)-3-phenyl-2-sulfanylpropanamide
C.C=C(C)C(OC(C)=O)c1ccc(OC(C)=O)c(OC)c1	[4-(1-acetyloxy-2-methylprop-2-enyl)-2-methoxyphenyl] acetate;methane
CN(CCCOc1cccc(/C=N/NC(=O)COCc2cc3ccc4cccc5ccc(c2)c3c45)c1)CCC(O)(P(=O)([O-])O)P(=O)([O-])O.[Na+].[Na+]	disodium;hydroxy-[1-hydroxy-1-[hydroxy(oxido)phosphoryl]-3-[methyl-[3-[3-[(E)-[[2-(pyren-2-ylmethoxy)acetyl]hydrazinylidene]methyl]phenoxy]propyl]amino]propyl]phosphinate
Cc1nn(C)c(=O)c(C(=O)NC2COCC2C(=O)O)c1C	4-[(2,5,6-trimethyl-3-oxopyridazine-4-carbonyl)amino]oxolane-3-carboxylic acid
C=CC[C@@H](CC(=O)C(F)(F)F)C(=O)OC	methyl (2S)-2-(3,3,3-trifluoro-2-oxopropyl)pent-4-enoate
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(C#CCC4CCN(C(=O)OCC5CCC(=O)N5)CC4)nc32)[C@@H](O)C1O	(5-oxopyrrolidin-2-yl)methyl 4-[3-[6-amino-9-[(2R,3S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purin-2-yl]prop-2-ynyl]piperidine-1-carboxylate
O=[N+]([O-])c1ccc2c(c1)SC1=N[C@H](c3ccccc3)CN12	(2R)-6-nitro-2-phenyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole
COCC(=O)N(C1CC1)[C@@H](CC(=O)NC[C@@H]1CCCN(C=NN)C1)C(=O)NCCNC(=O)c1cnccn1	(2S)-2-[cyclopropyl-(2-methoxyacetyl)amino]-N'-[[(3S)-1-methanehydrazonoylpiperidin-3-yl]methyl]-N-[2-(pyrazine-2-carbonylamino)ethyl]butanediamide
CN(C)CCOCCNC1CCOC2(CCC2)C1	N-[2-[2-(dimethylamino)ethoxy]ethyl]-5-oxaspiro[3.5]nonan-8-amine
Cn1c(=O)n(CC(C)(C)C)c2ccc(-c3cccc(COS(C)(=O)=O)c3)nc21	[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]phenyl]methyl methanesulfonate
CCCc1nnc(NC(C)c2cn(C(C)(C)C)nc2C)s1	N-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethyl]-5-propyl-1,3,4-thiadiazol-2-amine
C[C@H](OC(=O)/C=C/c1ccccc1[N+](=O)[O-])C(=O)N(C)C1CCCCC1	[(2S)-1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl] (E)-3-(2-nitrophenyl)prop-2-enoate
CC(C)(C)OC(=O)N1CCCC(NC(=O)OCc2ccccc2)CC1.N#Cc1ccccc1S(=O)(=O)N1CCCC(NC(=O)[C@H](CC2CCCC2)NC(=O)c2cc3ccccc3s2)CC1	tert-butyl 4-(phenylmethoxycarbonylamino)azepane-1-carboxylate;N-[(2S)-1-[[1-(2-cyanophenyl)sulfonylazepan-4-yl]amino]-3-cyclopentyl-1-oxopropan-2-yl]-1-benzothiophene-2-carboxamide
COc1cccc(CC(=O)N2CCCCc3ccccc32)c1	2-(3-methoxyphenyl)-1-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethanone
Cc1cc(=O)oc2cc(Oc3c(N)cncc3Br)ccc12	7-(3-amino-5-bromopyridin-4-yl)oxy-4-methylchromen-2-one
NS(=O)(=O)c1ccccc1-c1ccc(CNC(=O)[C@@H]2CCC[C@H]2C(=O)N2CCCCC2)cc1	(1R,2R)-2-(piperidine-1-carbonyl)-N-[[4-(2-sulfamoylphenyl)phenyl]methyl]cyclopentane-1-carboxamide
CN=C(NCc1nnc2n1CCC2)N1CCS(=O)(=O)C(C)(C)C1	N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-N',2,2-trimethyl-1,1-dioxo-1,4-thiazinane-4-carboximidamide
N#Cc1ccc(-c2nc(-c3ccccc3)c3oc4ccc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc4c3n2)cc1	4-[8-(3-carbazol-9-ylphenyl)-4-phenyl-[1]benzofuro[3,2-d]pyrimidin-2-yl]benzonitrile
CCCCC(=NNC(=O)COc1ccc(Br)c(C)c1)c1ccccc1	2-(4-bromo-3-methylphenoxy)-N-(1-phenylpentylideneamino)acetamide
COc1ccc2[nH]c(-c3cc4c(c(SC)n3)CCC4)cc2c1	5-methoxy-2-(1-methylsulfanyl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl)-1H-indole
COc1cccc(CNc2ncnc3ccc(C)cc23)c1	N-[(3-methoxyphenyl)methyl]-6-methylquinazolin-4-amine
CCS(=O)(=O)c1ccccc1C(=O)N(C)CC(=O)N1CCC(C(=O)O)CC1	1-[2-[(2-ethylsulfonylbenzoyl)-methylamino]acetyl]piperidine-4-carboxylic acid
CCCC1CCC(NCc2nc(C)ccc2O)CC1	6-methyl-2-[[(4-propylcyclohexyl)amino]methyl]pyridin-3-ol
CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(OCCCCC(=O)NCCOCCCNC(=O)c7ccc(C(=O)O)c(-c8c9cc(F)c(=[N+]%10CC(F)(F)C%10)cc-9oc9cc(N%10CC(F)(F)C%10)c(F)cc89)c7)cc6)[nH]c5c4)[nH]c3c2)CC1	2-[3-(3,3-difluoroazetidin-1-ium-1-ylidene)-6-(3,3-difluoroazetidin-1-yl)-2,7-difluoroxanthen-9-yl]-4-[3-[2-[5-[4-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenoxy]pentanoylamino]ethoxy]propylcarbamoyl]benzoic acid
CCCN(Cc1ccc(C(=O)O)cc1)S(=O)(=O)c1ccc(OC)c(OC)c1	4-[[(3,4-dimethoxyphenyl)sulfonyl-propylamino]methyl]benzoic acid
CC(C)[Si](OCC1(Br)CC1(Br)Br)(C(C)C)C(C)C	tri(propan-2-yl)-[(1,2,2-tribromocyclopropyl)methoxy]silane
CC12CCC(/C(=N/N)C1=O)C2(C)C(=O)O	(3Z)-3-hydrazinylidene-1,7-dimethyl-2-oxobicyclo[2.2.1]heptane-7-carboxylic acid
CC[C@H]1CN(c2nc(N)c(C(=O)NC(N)=NC)nc2Cl)CCN1C1CCN(Cc2ccc(Cl)c(F)c2)CC1.CC[C@H]1CN(c2nc(N)c(C(=O)NC3CC3)nc2Cl)CCN1C1CCN(Cc2ccc(Cl)cc2CN)CC1.CC[C@H]1CN(c2ncc(C(N)=O)nc2Br)CCN1C1CCN(C(=O)c2ccc(Cl)cc2)CC1.CC[C@H]1CN(c2ncc(C(N)=O)nc2C)CCN1C1CCN(Cc2ccc(Cl)cc2)CC1	3-amino-5-[(3S)-4-[1-[[2-(aminomethyl)-4-chlorophenyl]methyl]piperidin-4-yl]-3-ethylpiperazin-1-yl]-6-chloro-N-cyclopropylpyrazine-2-carboxamide;3-amino-6-chloro-5-[(3S)-4-[1-[(4-chloro-3-fluorophenyl)methyl]piperidin-4-yl]-3-ethylpiperazin-1-yl]-N-(N'-methylcarbamimidoyl)pyrazine-2-carboxamide;6-bromo-5-[(3S)-4-[1-(4-chlorobenzoyl)piperidin-4-yl]-3-ethylpiperazin-1-yl]pyrazine-2-carboxamide;5-[(3S)-4-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-ethylpiperazin-1-yl]-6-methylpyrazine-2-carboxamide
Oc1ccccc1OC1CNC1	2-(azetidin-3-yloxy)phenol
OC[C@@H]1CN(Cc2ccc(Cl)s2)C[C@@H]1CN1CCOCC1	[(3S,4S)-1-[(5-chlorothiophen-2-yl)methyl]-4-(morpholin-4-ylmethyl)pyrrolidin-3-yl]methanol

CCC1(C)NC(=O)N(NC(=O)CN2CCN(Cc3ccccc3F)CC2)C1=O

N-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]acetamide

COC(=O)NC(C)(C)Nc1nccc(-c2cn(C(C)C)nc2-c2cc(Cl)cc(NS(C)(=O)=O)c2Cl)n1

methyl N-[2-[[4-[3-[2,5-dichloro-3-(methanesulfonamido)phenyl]-1-propan-2-ylpyrazol-4-yl]pyrimidin-2-yl]amino]propan-2-yl]carbamate

C=CCNC(=O)C1CC(c2cccc(C)c2)CN(C(=O)Nc2cccc(OC)c2)C1

1-N-(3-methoxyphenyl)-5-(3-methylphenyl)-3-N-prop-2-enylpiperidine-1,3-dicarboxamide

COc1ccc(-c2noc(CN(C(=O)C(C)C)C(C)C)n2)cc1

N-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methyl-N-propan-2-ylpropanamide

Cc1nc2c3cc(F)c(C)cc3nc(N3CCNCC3)n2n1.Cl

9-fluoro-2,8-dimethyl-5-piperazin-1-yl-[1,2,4]triazolo[1,5-c]quinazoline;hydrochloride

Cc1cc(-c2sc(Nc3ccncc3)nc2-c2cccc(C#N)c2)ncn1

3-[5-(6-methylpyrimidin-4-yl)-2-(pyridin-4-ylamino)-1,3-thiazol-4-yl]benzonitrile

CC(=O)c1ccc(S(=O)(=O)Nc2ccc(N3CCC(Cc4ccccc4)CC3)c(C(=O)O)c2)cc1.O=C(O)C(F)(F)F

5-[(4-acetylphenyl)sulfonylamino]-2-(4-benzylpiperidin-1-yl)benzoic acid;2,2,2-trifluoroacetic acid

C=COc1ccc(C(CCCC(c2cc(C)c(OC=C)c(C)c2)c2cc(C)c(OC=C)cc2C)c2cc(C)c(OC=C)c(C)c2)cc1C

1-[1,5-bis(4-ethenoxy-3,5-dimethylphenyl)-5-(4-ethenoxy-3-methylphenyl)pentyl]-4-ethenoxy-2,5-dimethylbenzene

Cc1csc(CC2(N)CCC(Oc3ccc4c(c3)CCC(c3ccccc3)O4)CC2)n1

1-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-[(2-phenyl-3,4-dihydro-2H-chromen-6-yl)oxy]cyclohexan-1-amine

O=CN(CC1Sc2ccccc2NC1=O)OCc1ccccc1

N-[(3-oxo-4H-1,4-benzothiazin-2-yl)methyl]-N-phenylmethoxyformamide

C[C@@H]1CC(F)(F)CN1C(=O)OC(C)(C)C.C[C@@H]1CCc2ccccc2C1.NC(=O)c1cn[nH]c1N

5-amino-1H-pyrazole-4-carboxamide;tert-butyl (2R)-4,4-difluoro-2-methylpyrrolidine-1-carboxylate;(2R)-2-methyl-1,2,3,4-tetrahydronaphthalene

O=S(=O)(F)N1CCC(Nc2nc3ccccc3s2)CC1

4-(1,3-benzothiazol-2-ylamino)piperidine-1-sulfonyl fluoride

CC(C)CCOc1cccc(CCNC(=O)[C@H]2CCC(=O)NC(=O)N2)c1

(4R)-N-[2-[3-(3-methylbutoxy)phenyl]ethyl]-2,7-dioxo-1,3-diazepane-4-carboxamide

Cc1ccc(CC2=N[C@@H](C(=O)O)C(C)(C)S2)c(O)c1

(4S)-2-[(2-hydroxy-4-methylphenyl)methyl]-5,5-dimethyl-4H-1,3-thiazole-4-carboxylic acid

COc1ccc(C(C)NCc2cccc(O)c2)cc1F

3-[[1-(3-fluoro-4-methoxyphenyl)ethylamino]methyl]phenol

Nc1ccc(Cl)cc1C(=O)OCC(=O)c1c(-c2ccccc2)[nH]c2ccccc12

[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl] 2-amino-5-chlorobenzoate

C[C@H]1CCN2C(=O)[C@@H](NC(=O)NC3([C@H]4CN(C)CCS4(=O)=O)CCCCC3)CCCCCCCCCC[C@@H](C(=O)C(=O)NC3CC3)NC(=O)[C@H]12

N-cyclopropyl-2-[(3S,14S,17S,18S)-18-methyl-3-[[1-[(2R)-4-methyl-1,1-dioxo-1,4-thiazinan-2-yl]cyclohexyl]carbamoylamino]-2,16-dioxo-1,15-diazabicyclo[15.3.0]icosan-14-yl]-2-oxoacetamide

CN(C(=O)c1ccc(OCCCCC(=O)OCc2ccccc2)cc1C=O)C1CCC(=O)NC1=O

benzyl 5-[4-[(2,6-dioxopiperidin-3-yl)-methylcarbamoyl]-3-formylphenoxy]pentanoate

CCC1CCC(=O)OC1

5-ethyloxan-2-one

C/C1=C\CC[C@]2(C)O[C@H]2C[C@]2(C(C)C)CC[C@@](C)(O2)[C@H](O)CC1=O

(1S,3S,5S,8E,12R,13R)-12-hydroxy-5,9,13-trimethyl-1-propan-2-yl-4,16-dioxatricyclo[11.2.1.03,5]hexadec-8-en-10-one

CNC(=O)C1COCCN1C(=O)C1(N)CCCC(C)C1

4-(1-amino-3-methylcyclohexanecarbonyl)-N-methylmorpholine-3-carboxamide

Cc1cc(C)c2c(=O)cc(C(=O)Nc3ccc(S(=O)(=O)N4C[C@@H](C)O[C@@H](C)C4)cc3)oc2c1

N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide

CCN(C(=O)c1cc(F)c(N)c(F)c1)C(C)CN(C)C

4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethyl-3,5-difluorobenzamide

N=Nc1ncc(S(=O)(=O)O)s1

2-diazenyl-1,3-thiazole-5-sulfonic acid

NC(=O)Nc1ccc(NCc2csnn2)cc1

[4-(thiadiazol-4-ylmethylamino)phenyl]urea

COC(=O)C(=C/C(Cl)=C/N(C)C)C(=O)OC.COC(=O)c1cc(Cl)cn(Cc2ccc(Cl)nc2)c1=O.COC(=O)c1cc(Cl)cn(Cc2ccc(Cl)nc2)c1=O.COc1ccnc(NCCCCCN)n1.COc1ccnc(NCCCCCNC(=O)c2cc(Cl)cn(Cc3ccc(Cl)nc3)c2=O)n1.NCc1ccc(Cl)nc1

5-chloro-1-[(6-chloropyridin-3-yl)methyl]-N-[5-[(4-methoxypyrimidin-2-yl)amino]pentyl]-2-oxopyridine-3-carboxamide;(6-chloropyridin-3-yl)methanamine;dimethyl 2-[(Z)-2-chloro-3-(dimethylamino)prop-2-enylidene]propanedioate;N'-(4-methoxypyrimidin-2-yl)pentane-1,5-diamine;methyl 5-chloro-1-[(6-chloropyridin-3-yl)methyl]-2-oxopyridine-3-carboxylate

CN(C)C(=O)NCCNCc1cc(Cl)cc(Cl)c1O

3-[2-[(3,5-dichloro-2-hydroxyphenyl)methylamino]ethyl]-1,1-dimethylurea

CCN.CCNC1CCN(C(=O)OC(C)(C)C)CC1

tert-butyl 4-(ethylamino)piperidine-1-carboxylate;ethanamine

C=CCCC(=O)OC[C@H](NC(=O)[C@@H]1[C@@H]2CC[C@]3(O2)[C@H](C(=O)N(CC=C)c2c(C)cccc2Cl)N([C@@H](CC)CO)C(=O)[C@@H]13)c1ccccc1

[(2R)-2-[[(1R,2R,5S,6S,7S)-2-[(2-chloro-6-methylphenyl)-prop-2-enylcarbamoyl]-3-[(2S)-1-hydroxybutan-2-yl]-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]decane-6-carbonyl]amino]-2-phenylethyl] pent-4-enoate

COC(=O)/C=C/c1cccc(N(Cc2ccc(-c3ccc(OC)c(C)c3)cc2)C(=O)C2CCN(C(C)=O)CC2)c1

methyl (E)-3-[3-[(1-acetylpiperidine-4-carbonyl)-[[4-(4-methoxy-3-methylphenyl)phenyl]methyl]amino]phenyl]prop-2-enoate

CCC(NS(=O)(=O)CC)N(C)C

N-[1-(dimethylamino)propyl]ethanesulfonamide

CNCc1cc(-c2c(F)cccc2F)n(S(=O)(=O)c2cccnc2)c1Cl.O=C(O)/C=C/C(=O)O

(E)-but-2-enedioic acid;1-[2-chloro-5-(2,6-difluorophenyl)-1-pyridin-3-ylsulfonylpyrrol-3-yl]-N-methylmethanamine

CCCC(=O)O[C@]1(C(=O)COC(C)=O)CC[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C

[(6S,8S,9R,10S,11S,13S,14S,17R)-17-(2-acetyloxyacetyl)-6,9-difluoro-11-hydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] butanoate

CC(C)(C)CC(=O)Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6ccc(Cl)s6)cncc5[nH]4)c3n2)c1

N-[5-[3-[7-(5-chlorothiophen-2-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-pyrazolo[4,3-b]pyridin-5-yl]pyridin-3-yl]-3,3-dimethylbutanamide

C=C/C(=C\C=C(/C)C(=C)N1CCCc2ccccc21)C(=C)Cc1ccccc1CCCC

1-[(3E,5E)-7-[(2-butylphenyl)methyl]-6-ethenyl-3-methylocta-1,3,5,7-tetraen-2-yl]-3,4-dihydro-2H-quinoline

CCCN1C[C@H](NS(=O)(=O)c2c(C)cc(C)c3nonc23)CC1=O

5,7-dimethyl-N-[(3R)-5-oxo-1-propylpyrrolidin-3-yl]-2,1,3-benzoxadiazole-4-sulfonamide

CCCCCCCCCC/C=C\CCCCCCCCCCCCCCCCCC(=O)NC(COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)C(O)/C=C/CC/C=C/CCCCCCCCCCCCCC

(Z)-N-[(4E,8E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxytricosa-4,8-dien-2-yl]triacont-19-enamide

COc1ccccc1CN(C)c1nc(N2CCOCC2)nc(-n2c(C(F)F)nc3ccccc32)n1

4-[2-(difluoromethyl)benzimidazol-1-yl]-N-[(2-methoxyphenyl)methyl]-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

N#Cc1nc(-n2ccnc2)ccc1N

3-amino-6-imidazol-1-ylpyridine-2-carbonitrile

CNCC(=O)c1cc(C)n(C(C)C)c1C

1-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-(methylamino)ethanone

COCC1CCCCCCCCC1

methoxymethylcyclodecane

CC(C)(C)OC(=O)NCCC(=O)NCCCN1CCCCCC1

tert-butyl N-[3-[3-(azepan-1-yl)propylamino]-3-oxopropyl]carbamate

O=C1CCC(N2C(=O)c3ccc(CNC4C[C@H]5CNC[C@@H](C4)C5)cc3C2=O)C(=O)N1

5-[[[(1R,5S)-3-azabicyclo[3.3.1]nonan-7-yl]amino]methyl]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione

CCCC(=O)Oc1ccc(OC(F)F)c([N+](=O)[O-])c1

[4-(difluoromethoxy)-3-nitrophenyl] butanoate

[C-]#[N+]C1=C(O)[C@H](C)[C@H]2CCc3c(OC4CCCC4)nc(-c4ccnc5c(F)cccc45)nc3[C@]2(C)C1

(6aR,7R,10aR)-4-cyclopentyloxy-2-(8-fluoroquinolin-4-yl)-9-isocyano-7,10a-dimethyl-6,6a,7,10-tetrahydro-5H-benzo[h]quinazolin-8-ol

CCC(C)(C)OCCc1cccc(C(=O)O)c1

3-[2-(2-methylbutan-2-yloxy)ethyl]benzoic acid

NCC1CCCC2(CCOCC2)O1

1,9-dioxaspiro[5.5]undecan-2-ylmethanamine

CC(C)OC(=O)c1ccc(Cl)c(-c2ccccc2)n1.CC(C)OC(=O)c1ccc(F)c(-c2ccccc2)n1.C[N+](C)(C)C.Cc1ccc(C(=O)OC(C)C)nc1-c1ccccc1.F.O=C(O)c1ccc(F)c(-c2ccccc2)n1

5-fluoro-6-phenylpyridine-2-carboxylic acid;propan-2-yl 5-chloro-6-phenylpyridine-2-carboxylate;propan-2-yl 5-fluoro-6-phenylpyridine-2-carboxylate;propan-2-yl 5-methyl-6-phenylpyridine-2-carboxylate;tetramethylazanium;hydrofluoride

CC(C)Cn1nc(C(=O)Nc2ncc(Cc3ccccc3)s2)c2ccccc2c1=O

N-(5-benzyl-1,3-thiazol-2-yl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide

Cc1ccc(-c2cc(C(F)F)n3ncc(C(=O)Nc4ccc(Br)cc4F)c3n2)cc1

N-(4-bromo-2-fluorophenyl)-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

Cc1nn(C)c(C)c1-c1c(Cl)ccc2c(CCCOc3cccc4cc(F)ccc34)c(C(=O)OCCN3CCOCC3)n(CCN3CCN(C(=O)COc4cccc5c4CN(C4CCC(=O)NC4=O)C5=O)CC3)c12

2-morpholin-4-ylethyl 6-chloro-1-[2-[4-[2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-4-yl]oxy]acetyl]piperazin-1-yl]ethyl]-3-[3-(6-fluoronaphthalen-1-yl)oxypropyl]-7-(1,3,5-trimethylpyrazol-4-yl)indole-2-carboxylate

Cc1ccsc1/C=N\NC(=O)COc1ccc(C(C)(C)C)cc1Br

2-(2-bromo-4-tert-butylphenoxy)-N-[(Z)-(3-methylthiophen-2-yl)methylideneamino]acetamide

CCNC(=NCc1ccc(OC)c(OC)c1)NCc1ccc(CC)s1

2-[(3,4-dimethoxyphenyl)methyl]-1-ethyl-3-[(5-ethylthiophen-2-yl)methyl]guanidine

COc1ccc2cc3c(Nc4cc(F)ccc4F)[nH][nH]c-3c2c1

N-(2,5-difluorophenyl)-7-methoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine

CSC(SC)=C(C#N)C(=O)c1ccc(OC(F)(F)F)cc1

3,3-bis(methylsulfanyl)-2-[4-(trifluoromethoxy)benzoyl]prop-2-enenitrile

Br[Al](Br)Br.Br[Al](Br)Br.CC(=O)Br

acetyl bromide;tribromoalumane

CN(C)CCNC(=S)NCc1cccc(Cl)c1

1-[(3-chlorophenyl)methyl]-3-[2-(dimethylamino)ethyl]thiourea

Cc1cnc(C)n2nc(C=Cc3nc(N4CCC[C@@H]4C(F)(F)F)nn3C)nc12

5,8-dimethyl-2-[2-[2-methyl-5-[(2R)-2-(trifluoromethyl)pyrrolidin-1-yl]-1,2,4-triazol-3-yl]ethenyl]-[1,2,4]triazolo[1,5-c]pyrimidine

CC1CCC(NC(=O)CC2CCC(N)CC2)CC1

2-(4-aminocyclohexyl)-N-(4-methylcyclohexyl)acetamide

O=C(Nc1ccc(OCC2CC2)cc1)C1CSCN1

N-[4-(cyclopropylmethoxy)phenyl]-1,3-thiazolidine-4-carboxamide

CCCCOc1ccc(-c2ccc(Cl)c(/C=C/C(=O)Nc3ccc(S)cc3)c2)cc1

(E)-3-[5-(4-butoxyphenyl)-2-chlorophenyl]-N-(4-sulfanylphenyl)prop-2-enamide

CCOc1ccc(CNC(=O)CCn2cnc3onc(-c4ccccc4)c3c2=O)cc1

N-[(4-ethoxyphenyl)methyl]-3-(4-oxo-3-phenyl-[1,2]oxazolo[5,4-d]pyrimidin-5-yl)propanamide

CCC(C)NC(N)=NCCCOc1ccc(Cl)cc1C.I

1-butan-2-yl-2-[3-(4-chloro-2-methylphenoxy)propyl]guanidine;hydroiodide

C=CCn1c(SCC(=O)c2cc(C)n(CC=C)c2C)nnc1-c1ccncc1

1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

C/C=C(I)\C=C\N=C(C)C=N

2-N-[(1E,3E)-3-iodopenta-1,3-dienyl]propane-1,2-diimine

Cc1cc(-c2nc(-c3cc(C)c(OC[C@@H](O)CC(O)C(N)=O)c(C)c3)no2)cc(Cl)n1

(4S)-5-[4-[5-(2-chloro-6-methylpyridin-4-yl)-1,2,4-oxadiazol-3-yl]-2,6-dimethylphenoxy]-2,4-dihydroxypentanamide

COc1ccc(Cl)cc1NC(=O)CSc1ccc(-c2ccccc2)nn1

N-(5-chloro-2-methoxyphenyl)-2-(6-phenylpyridazin-3-yl)sulfanylacetamide

Cc1nc2sc3c(N4CCCC4)ncnc3c2c(C)c1Cl.Cl

12-chloro-11,13-dimethyl-6-pyrrolidin-1-yl-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene;hydrochloride

Cc1ccc(C)c2c1C(=O)c1c(NCCN(C)C)ccc(NCCN(C)C)c1C2=O

1,4-bis[2-(dimethylamino)ethylamino]-5,8-dimethylanthracene-9,10-dione

CCCCCCOC(=O)Nc1ccc(Cc2ccc(NC(=O)OC)cc2)cc1

methyl N-[4-[[4-(hexoxycarbonylamino)phenyl]methyl]phenyl]carbamate

Cc1csc(NC(=O)C(S)Cc2ccccc2)n1

N-(4-methyl-1,3-thiazol-2-yl)-3-phenyl-2-sulfanylpropanamide

C.C=C(C)C(OC(C)=O)c1ccc(OC(C)=O)c(OC)c1

[4-(1-acetyloxy-2-methylprop-2-enyl)-2-methoxyphenyl] acetate;methane

CN(CCCOc1cccc(/C=N/NC(=O)COCc2cc3ccc4cccc5ccc(c2)c3c45)c1)CCC(O)(P(=O)([O-])O)P(=O)([O-])O.[Na+].[Na+]

disodium;hydroxy-[1-hydroxy-1-[hydroxy(oxido)phosphoryl]-3-[methyl-[3-[3-[(E)-[[2-(pyren-2-ylmethoxy)acetyl]hydrazinylidene]methyl]phenoxy]propyl]amino]propyl]phosphinate

Cc1nn(C)c(=O)c(C(=O)NC2COCC2C(=O)O)c1C

4-[(2,5,6-trimethyl-3-oxopyridazine-4-carbonyl)amino]oxolane-3-carboxylic acid

C=CC[C@@H](CC(=O)C(F)(F)F)C(=O)OC

methyl (2S)-2-(3,3,3-trifluoro-2-oxopropyl)pent-4-enoate

CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(C#CCC4CCN(C(=O)OCC5CCC(=O)N5)CC4)nc32)[C@@H](O)C1O

(5-oxopyrrolidin-2-yl)methyl 4-[3-[6-amino-9-[(2R,3S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purin-2-yl]prop-2-ynyl]piperidine-1-carboxylate

O=[N+]([O-])c1ccc2c(c1)SC1=N[C@H](c3ccccc3)CN12

(2R)-6-nitro-2-phenyl-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole

COCC(=O)N(C1CC1)[C@@H](CC(=O)NC[C@@H]1CCCN(C=NN)C1)C(=O)NCCNC(=O)c1cnccn1

(2S)-2-[cyclopropyl-(2-methoxyacetyl)amino]-N'-[[(3S)-1-methanehydrazonoylpiperidin-3-yl]methyl]-N-[2-(pyrazine-2-carbonylamino)ethyl]butanediamide

CN(C)CCOCCNC1CCOC2(CCC2)C1

N-[2-[2-(dimethylamino)ethoxy]ethyl]-5-oxaspiro[3.5]nonan-8-amine

Cn1c(=O)n(CC(C)(C)C)c2ccc(-c3cccc(COS(C)(=O)=O)c3)nc21

[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]phenyl]methyl methanesulfonate

CCCc1nnc(NC(C)c2cn(C(C)(C)C)nc2C)s1

N-[1-(1-tert-butyl-3-methylpyrazol-4-yl)ethyl]-5-propyl-1,3,4-thiadiazol-2-amine

C[C@H](OC(=O)/C=C/c1ccccc1[N+](=O)[O-])C(=O)N(C)C1CCCCC1

[(2S)-1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl] (E)-3-(2-nitrophenyl)prop-2-enoate

CC(C)(C)OC(=O)N1CCCC(NC(=O)OCc2ccccc2)CC1.N#Cc1ccccc1S(=O)(=O)N1CCCC(NC(=O)[C@H](CC2CCCC2)NC(=O)c2cc3ccccc3s2)CC1

tert-butyl 4-(phenylmethoxycarbonylamino)azepane-1-carboxylate;N-[(2S)-1-[[1-(2-cyanophenyl)sulfonylazepan-4-yl]amino]-3-cyclopentyl-1-oxopropan-2-yl]-1-benzothiophene-2-carboxamide

COc1cccc(CC(=O)N2CCCCc3ccccc32)c1

2-(3-methoxyphenyl)-1-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethanone

Cc1cc(=O)oc2cc(Oc3c(N)cncc3Br)ccc12

7-(3-amino-5-bromopyridin-4-yl)oxy-4-methylchromen-2-one

NS(=O)(=O)c1ccccc1-c1ccc(CNC(=O)[C@@H]2CCC[C@H]2C(=O)N2CCCCC2)cc1

(1R,2R)-2-(piperidine-1-carbonyl)-N-[[4-(2-sulfamoylphenyl)phenyl]methyl]cyclopentane-1-carboxamide

CN=C(NCc1nnc2n1CCC2)N1CCS(=O)(=O)C(C)(C)C1

N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-N',2,2-trimethyl-1,1-dioxo-1,4-thiazinane-4-carboximidamide

N#Cc1ccc(-c2nc(-c3ccccc3)c3oc4ccc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc4c3n2)cc1

4-[8-(3-carbazol-9-ylphenyl)-4-phenyl-[1]benzofuro[3,2-d]pyrimidin-2-yl]benzonitrile

CCCCC(=NNC(=O)COc1ccc(Br)c(C)c1)c1ccccc1

2-(4-bromo-3-methylphenoxy)-N-(1-phenylpentylideneamino)acetamide

COc1ccc2[nH]c(-c3cc4c(c(SC)n3)CCC4)cc2c1

5-methoxy-2-(1-methylsulfanyl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl)-1H-indole

COc1cccc(CNc2ncnc3ccc(C)cc23)c1

N-[(3-methoxyphenyl)methyl]-6-methylquinazolin-4-amine

CCS(=O)(=O)c1ccccc1C(=O)N(C)CC(=O)N1CCC(C(=O)O)CC1

1-[2-[(2-ethylsulfonylbenzoyl)-methylamino]acetyl]piperidine-4-carboxylic acid

CCCC1CCC(NCc2nc(C)ccc2O)CC1

6-methyl-2-[[(4-propylcyclohexyl)amino]methyl]pyridin-3-ol

CN1CCN(c2ccc3nc(-c4ccc5nc(-c6ccc(OCCCCC(=O)NCCOCCCNC(=O)c7ccc(C(=O)O)c(-c8c9cc(F)c(=[N+]%10CC(F)(F)C%10)cc-9oc9cc(N%10CC(F)(F)C%10)c(F)cc89)c7)cc6)[nH]c5c4)[nH]c3c2)CC1

2-[3-(3,3-difluoroazetidin-1-ium-1-ylidene)-6-(3,3-difluoroazetidin-1-yl)-2,7-difluoroxanthen-9-yl]-4-[3-[2-[5-[4-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenoxy]pentanoylamino]ethoxy]propylcarbamoyl]benzoic acid

CCCN(Cc1ccc(C(=O)O)cc1)S(=O)(=O)c1ccc(OC)c(OC)c1

4-[[(3,4-dimethoxyphenyl)sulfonyl-propylamino]methyl]benzoic acid

CC(C)[Si](OCC1(Br)CC1(Br)Br)(C(C)C)C(C)C

tri(propan-2-yl)-[(1,2,2-tribromocyclopropyl)methoxy]silane

CC12CCC(/C(=N/N)C1=O)C2(C)C(=O)O

(3Z)-3-hydrazinylidene-1,7-dimethyl-2-oxobicyclo[2.2.1]heptane-7-carboxylic acid

CC[C@H]1CN(c2nc(N)c(C(=O)NC(N)=NC)nc2Cl)CCN1C1CCN(Cc2ccc(Cl)c(F)c2)CC1.CC[C@H]1CN(c2nc(N)c(C(=O)NC3CC3)nc2Cl)CCN1C1CCN(Cc2ccc(Cl)cc2CN)CC1.CC[C@H]1CN(c2ncc(C(N)=O)nc2Br)CCN1C1CCN(C(=O)c2ccc(Cl)cc2)CC1.CC[C@H]1CN(c2ncc(C(N)=O)nc2C)CCN1C1CCN(Cc2ccc(Cl)cc2)CC1

3-amino-5-[(3S)-4-[1-[[2-(aminomethyl)-4-chlorophenyl]methyl]piperidin-4-yl]-3-ethylpiperazin-1-yl]-6-chloro-N-cyclopropylpyrazine-2-carboxamide;3-amino-6-chloro-5-[(3S)-4-[1-[(4-chloro-3-fluorophenyl)methyl]piperidin-4-yl]-3-ethylpiperazin-1-yl]-N-(N'-methylcarbamimidoyl)pyrazine-2-carboxamide;6-bromo-5-[(3S)-4-[1-(4-chlorobenzoyl)piperidin-4-yl]-3-ethylpiperazin-1-yl]pyrazine-2-carboxamide;5-[(3S)-4-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-ethylpiperazin-1-yl]-6-methylpyrazine-2-carboxamide

Oc1ccccc1OC1CNC1

2-(azetidin-3-yloxy)phenol

OC[C@@H]1CN(Cc2ccc(Cl)s2)C[C@@H]1CN1CCOCC1

[(3S,4S)-1-[(5-chlorothiophen-2-yl)methyl]-4-(morpholin-4-ylmethyl)pyrrolidin-3-yl]methanol