AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-6

SMILES stringlengths 2 1.33k	IUPAC stringlengths 6 1.6k
CN1c2ccccc2Sc2oc[n+](N)c21	4-methyl-[1,3]oxazolo[5,4-b][1,4]benzothiazin-3-ium-3-amine
CCNCCCNC(=O)c1ccc(Nc2nc(NCc3ccc(OC)cc3)nc(OCC(F)(F)F)n2)cc1	N-[3-(ethylamino)propyl]-4-[[4-[(4-methoxyphenyl)methylamino]-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl]amino]benzamide
CCC1(CCC2CCCCS2)CCCCN1	2-ethyl-2-[2-(thian-2-yl)ethyl]piperidine
O=C(CN1CCC(C2OCCO2)CC1)Nc1ccc(Cl)c(C(F)(F)F)c1	N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(1,3-dioxolan-2-yl)piperidin-1-yl]acetamide
Cc1ccc(-c2ccc3c(c2)oc2ccccc23)cc1.Cc1ccc(-c2cccc3c2oc2ccccc23)cc1.Cc1ccc2c(c1)oc1cc(-c3ccccc3)ccc12.Cc1cccc(-c2ccc3c(c2)oc2ccccc23)c1.Cc1cccc(-c2cccc3c2oc2ccccc23)c1.Cc1ccccc1-c1ccc2c(c1)oc1ccccc12.Cc1ccccc1-c1ccc2oc3ccccc3c2c1	2-(2-methylphenyl)dibenzofuran;3-(2-methylphenyl)dibenzofuran;3-(3-methylphenyl)dibenzofuran;3-(4-methylphenyl)dibenzofuran;3-methyl-7-phenyldibenzofuran;4-(3-methylphenyl)dibenzofuran;4-(4-methylphenyl)dibenzofuran
Cc1cc(CN)cc(S(=O)(=O)NC(C)C(C)C)c1Br	5-(aminomethyl)-2-bromo-3-methyl-N-(3-methylbutan-2-yl)benzenesulfonamide
Cc1ccc(C)c(-c2nc(NC(=O)CCN)sc2C(C)C)c1	3-amino-N-[4-(2,5-dimethylphenyl)-5-propan-2-yl-1,3-thiazol-2-yl]propanamide
C=CCc1cccc2c1c1ccccc1n2-c1cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc(-n2c3ccccc3c3ccccc32)c1	9-[3-carbazol-9-yl-5-(3,5-diphenylphenyl)phenyl]-4-prop-2-enylcarbazole
C=CCn1c(SC(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c2ccccc2)nnc1C1CC1	N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenylacetamide
COc1cc(C#N)ccc1OCCCC(=O)NCCOc1ccccc1-c1ccccc1	4-(4-cyano-2-methoxyphenoxy)-N-[2-(2-phenylphenoxy)ethyl]butanamide
N#Cc1ccc(OCC(=O)N2CC[C@H]3CCCC[C@@H]3C2)cc1	4-[2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-oxoethoxy]benzonitrile
Cc1ccc(C#N)c(Nc2cccc(F)c2C)n1	2-(3-fluoro-2-methylanilino)-6-methylpyridine-3-carbonitrile
C/C=C\N(C)/N=C(\C)C(F)(F)F	(Z)-N-methyl-N-[(E)-1,1,1-trifluoropropan-2-ylideneamino]prop-1-en-1-amine
CC1(C)COC(C(Cc2ccccc2)C(=O)c2ccccc2)=N1	2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-1,3-diphenylpropan-1-one
Cc1cc(N2C(=O)c3oc4cc(C)c(C)cc4c(=O)c3[C@H]2c2cccnc2)no1	(1R)-6,7-dimethyl-2-(5-methyl-1,2-oxazol-3-yl)-1-pyridin-3-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
CCc1ccc(SNC(C)(C)C=O)cc1	2-[(4-ethylphenyl)sulfanylamino]-2-methylpropanal
CC(CCC(=O)NCCN)C1CCC2C3C(O)CC4CCCCC4(C)C3CC(O)C12C	N-(2-aminoethyl)-4-(7,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamide
CCC(C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NC	N-butan-2-yl-2-(methylamino)-4-nitrobenzenesulfonamide
COc1cc(NC(=O)C(C)(C)C)c(C(=O)O)cc1OC	2-(2,2-dimethylpropanoylamino)-4,5-dimethoxybenzoic acid
COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1	(E)-3-[5-(2-chloro-5-nitrophenyl)furan-2-yl]-2-cyano-N-(2-methoxy-5-methylphenyl)prop-2-enamide
CCn1ncc(Cl)c1C(N)c1cccc(C)n1	(4-chloro-2-ethylpyrazol-3-yl)-(6-methylpyridin-2-yl)methanamine
CCOC(=O)C1=C(CSS(=O)(=O)c2ccc(C)cc2)NC(C)=C(C(=O)OC)C1c1cccc([N+](=O)[O-])c1	5-O-ethyl 3-O-methyl 2-methyl-6-[(4-methylphenyl)sulfonylsulfanylmethyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
C/C(N)=C(/C=N)CO	(E)-3-amino-2-methanimidoylbut-2-en-1-ol
CCCCC[C@@H]1O[C@@H](O[C@H]2[C@H](OC([C@H]3COC(C)(C)O3)[C@@H]3OC(C)(C)O[C@H]3C(OC)OC)O[C@H](COC(=O)c3ccccc3)[C@@H]3OC(C)(C)O[C@@H]32)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1	[(3aS,4R,6S,7R,7aS)-6-[[(4S,5R)-5-(dimethoxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,2-dimethyl-7-[(2S,3S,4R,5R,6S)-6-pentyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-4-yl]methyl benzoate
CCC1CCC(Br)CC1C	4-bromo-1-ethyl-2-methylcyclohexane
O=C(CC1CC2CCC(C1)N2)N1CCCCO1	2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(oxazinan-2-yl)ethanone
CC(=O)Nc1cccc(C(=O)N/N=C\c2ccc(N(C)C)cc2)c1	3-acetamido-N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]benzamide
C=C(C)C(N)CC/C(C)=C/C	(6E)-2,6-dimethylocta-1,6-dien-3-amine
Cc1ccc(S(=O)(=O)CC(C)NC2c3ccccc3CC2O)cc1	1-[1-(4-methylphenyl)sulfonylpropan-2-ylamino]-2,3-dihydro-1H-inden-2-ol
C[Si](C)(C)N=C(N[Si](C)(C)C)c1c(F)cccc1F	2,6-difluoro-N,N'-bis(trimethylsilyl)benzenecarboximidamide
CCN1CCOC(CNCc2ccc(OC)c(F)c2)C1	1-(4-ethylmorpholin-2-yl)-N-[(3-fluoro-4-methoxyphenyl)methyl]methanamine
CC(C)c1cc(F)cc2c1cc1n2CCCC1CC(=O)O	2-(3-fluoro-1-propan-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]indol-9-yl)acetic acid
Nc1ccc(C(=O)N2CC[C@@H](c3c(C(=O)N4CCOCC4)sc4ncccc34)C2)cn1	(6-aminopyridin-3-yl)-[(3S)-3-[2-(morpholine-4-carbonyl)thieno[2,3-b]pyridin-3-yl]pyrrolidin-1-yl]methanone
CC(C)(NCc1ccc(C#N)cc1)C(N)c1ccnc2cc(Cl)ccc12	4-[[[1-amino-1-(7-chloroquinolin-4-yl)-2-methylpropan-2-yl]amino]methyl]benzonitrile
CS(=O)(=O)c1cccc(Oc2nc(N[C@H]3CCCNC3)ncc2C(F)(F)F)c1	4-(3-methylsulfonylphenoxy)-N-[(3S)-piperidin-3-yl]-5-(trifluoromethyl)pyrimidin-2-amine
c1ccc(-c2cc(-n3c4ccc(-c5ccc6ccccc6c5)cc4c4cc5c6cc(-c7ccc8ccccc8c7)ccc6c6ccccc6c5cc43)cc(-c3ccccc3)n2)cc1	23-(2,6-diphenylpyridin-4-yl)-11,19-dinaphthalen-2-yl-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8(13),9,11,14,16(24),17(22),18,20-dodecaene
C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)N=C=S	(2R)-2-(2,4-dichlorophenoxy)propanoyl isothiocyanate
COc1ccccc1NC(=O)C1CC1C(=O)N(C)CCc1ccncc1	2-N-(2-methoxyphenyl)-1-N-methyl-1-N-(2-pyridin-4-ylethyl)cyclopropane-1,2-dicarboxamide
CC[C@@H]1CN(Cc2cc(C(c3ccc4c(nnn4CC)c3C)C(C)(C)C(=O)NCC(N)=O)ccc2C)S(=O)(=O)c2ccccc2O1	N-(2-amino-2-oxoethyl)-3-[3-[[(4R)-4-ethyl-1,1-dioxo-3,4-dihydro-5,1λ6,2-benzoxathiazepin-2-yl]methyl]-4-methylphenyl]-3-(1-ethyl-4-methylbenzotriazol-5-yl)-2,2-dimethylpropanamide
Cn1c(SCc2nnsc2NN)n[nH]c1=O	3-[(5-hydrazinylthiadiazol-4-yl)methylsulfanyl]-4-methyl-1H-1,2,4-triazol-5-one
Cc1ccc(NC(=O)COc2c(Cl)cc(C3C4=C(CC(C)(C)CC4=O)OC4=C3C(=O)CC(C)(C)C4)cc2Cl)cc1	2-[2,6-dichloro-4-(3,3,6,6-tetramethyl-1,8-dioxo-4,5,7,9-tetrahydro-2H-xanthen-9-yl)phenoxy]-N-(4-methylphenyl)acetamide
C#CC(/C(C)=C\C(=C/C)C1=C(C)C(CC)CC=C1C)/C(=C\C)c1ccc(C2OC2C)cc1	2-[4-[(2E,5Z,7E)-7-(3-ethyl-2,6-dimethylcyclohexa-1,5-dien-1-yl)-4-ethynyl-5-methylnona-2,5,7-trien-3-yl]phenyl]-3-methyloxirane
CNc1ccc2c(c1)N(CCC(=O)OC)C(=O)CO2	methyl 3-[6-(methylamino)-3-oxo-1,4-benzoxazin-4-yl]propanoate
CC1NCCCC1NC(=O)CC(N)c1ccccc1	3-amino-N-(2-methylpiperidin-3-yl)-3-phenylpropanamide
CC(=O)Nc1ncc(S(=O)(=O)N2CCN(c3cc(C)nc(NC4CCCCC4)n3)CC2)s1	N-[5-[4-[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]piperazin-1-yl]sulfonyl-1,3-thiazol-2-yl]acetamide
O=C(NCc1ccccc1CN1CCOCC1)c1cccc(OC[C@@H]2CCCO2)c1	N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-3-[[(2S)-oxolan-2-yl]methoxy]benzamide
COc1ccc(CNC(=O)[C@@H]2CN(C)CC[C@@H]2O)cc1F.O=CO	(3R,4S)-N-[(3-fluoro-4-methoxyphenyl)methyl]-4-hydroxy-1-methylpiperidine-3-carboxamide;formic acid
CC1(C)c2ccc([nH]2)-c2ccc([nH]2)C(C)(C)c2ccc(s2)C(C)(C)c2ccc([nH]2)-c2ccc([nH]2)C(C)(C)c2ccc1s2	6,6,11,11,20,20,25,25-octamethyl-30,33-dithia-29,31,32,34-tetrazaheptacyclo[24.2.1.12,5.17,10.112,15.116,19.121,24]tetratriaconta-1(28),2,4,7,9,12,14,16,18,21,23,26-dodecaene
C[C@H](CCC(=O)NCS(=O)(=O)[O-])[C@H]1CCC2C3C(CC[C@@]21C)[C@@]1(C)CC(F)(F)[C@H](O)C[C@H]1C[C@@H]3O.C[C@H](CCC(=O)O)[C@H]1CCC2C3C(CC[C@@]21C)[C@@]1(C)CC(F)(F)[C@H](O)C[C@H]1C[C@@H]3O.[Na+]	sodium;(4R)-4-[(3R,5R,7S,10S,13R,17R)-2,2-difluoro-3,7-dihydroxy-10,13-dimethyl-1,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid;[[(4R)-4-[(3R,5R,7S,10S,13R,17R)-2,2-difluoro-3,7-dihydroxy-10,13-dimethyl-1,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoyl]amino]methanesulfonate
Cc1nc(NC2CCC(C)C(C)C2)ccc1C(=O)O	6-[(3,4-dimethylcyclohexyl)amino]-2-methylpyridine-3-carboxylic acid
CC(C)=NNC(=O)c1cc(-c2ccc([N+](=O)[O-])s2)nc2ccccc12	2-(5-nitrothiophen-2-yl)-N-(propan-2-ylideneamino)quinoline-4-carboxamide
COC(CCCCCCCCC(=O)[O-])CC(=O)[O-]	3-methoxydodecanedioate
COc1cccc(CN2CCc3nc(Nc4ccccc4)ncc3C2)c1OC	6-[(2,3-dimethoxyphenyl)methyl]-N-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine
CN(CCCNC(=O)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1)c1ccccc1	5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[3-(N-methylanilino)propyl]furan-2-carboxamide
CNC(=S)NCCCCC(NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12)C(=O)NC(CC(C)C)[C@@H](O)CC(=O)N(C)OC	(3S)-3-hydroxy-N-methoxy-N,6-dimethyl-4-[[6-(methylcarbamothioylamino)-2-[[3-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoyl]amino]hexanoyl]amino]heptanamide
Cc1cc(NCCCNS(C)(=O)=O)c(C(N)=S)c(C)n1	4-[3-(methanesulfonamido)propylamino]-2,6-dimethylpyridine-3-carbothioamide
O=C(/C=C/c1cccc(Cl)c1)OCC(=O)c1ccc(C2CCCCC2)cc1	[2-(4-cyclohexylphenyl)-2-oxoethyl] (E)-3-(3-chlorophenyl)prop-2-enoate
CC(C)c1cccc(-c2ncco2)c1F	2-(2-fluoro-3-propan-2-ylphenyl)-1,3-oxazole
CCCC=CC(CC)CCCPCC	ethyl(4-ethylnon-5-enyl)phosphane
CN=C(NCC1CCOc2ccccc21)N1CCN(CC(C)C)CC1	N-(3,4-dihydro-2H-chromen-4-ylmethyl)-N'-methyl-4-(2-methylpropyl)piperazine-1-carboximidamide
O=C1COc2ccc(OC(=O)c3ccccc3F)cc2N1	(3-oxo-4H-1,4-benzoxazin-6-yl) 2-fluorobenzoate
O=C(NCCSCc1c(F)cccc1Cl)c1ccccc1	N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]benzamide
N#Cc1c(C(F)(F)F)cc(C2=NN(c3cc(C(F)(F)F)c(C#N)c(C(F)(F)F)c3)C(O)C2C(OCCCCI)C(F)(F)F)cc1C(F)(F)F	4-[2-[4-cyano-3,5-bis(trifluoromethyl)phenyl]-3-hydroxy-4-[2,2,2-trifluoro-1-(4-iodobutoxy)ethyl]-3,4-dihydropyrazol-5-yl]-2,6-bis(trifluoromethyl)benzonitrile
CC(C)c1c(S(=O)(=O)N(Cc2ccccc2)S(C)(=O)=O)c(-c2ccc(F)cc2)c(-c2ccc(F)cc2)n1CCC(O)CC(O)CC(=O)O	7-[4-[benzyl(methylsulfonyl)sulfamoyl]-2,3-bis(4-fluorophenyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid
CN(C)C(CNC(=O)C1C2CCC(C2)C1N)c1ccccc1.Cl.Cl	3-amino-N-[2-(dimethylamino)-2-phenylethyl]bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride
COC(=O)c1ccc2ccn(Cc3cccc(CS(=O)(=O)c4ccccc4)c3)c2c1.COC(=O)c1ccc2ccn(Cc3cccc(N)c3)c2c1.O=S(=O)(Cl)c1ccccc1	benzenesulfonyl chloride;methyl 1-[(3-aminophenyl)methyl]indole-6-carboxylate;methyl 1-[[3-(benzenesulfonylmethyl)phenyl]methyl]indole-6-carboxylate
Cc1ccc(NC(=O)/C=C/C23CCC4C(CCC5C4(C)CCC4C(C)(C)C(OC(=O)CC(C)(C)C=O)CCC45C)C2=C(C(C)C)C(=O)C3)cc1	[5b,8,8,11a-tetramethyl-3a-[(E)-3-(4-methylanilino)-3-oxoprop-1-enyl]-2-oxo-1-propan-2-yl-3,4,5,5a,6,7,7a,9,10,11,11b,12,13,13a-tetradecahydrocyclopenta[a]chrysen-9-yl] 3,3-dimethyl-4-oxobutanoate
O=c1ccnc2ocnn12	[1,3,4]oxadiazolo[3,2-a]pyrimidin-5-one
Cc1cc(=O)[nH]c(CCNC(=O)C(C)(C)N2CCCC2)n1	2-methyl-N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-pyrrolidin-1-ylpropanamide
CCc1csc(C2CCCC(C)C2)n1	4-ethyl-2-(3-methylcyclohexyl)-1,3-thiazole
COc1cc2c(cc1NC(=O)[C@@H](C)Oc1nnc3ccccn13)oc1ccccc12	(2R)-N-(2-methoxydibenzofuran-3-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-yloxy)propanamide
CC(C)(C)C1CCN(C2CC2)CC1.CC(C)(C)C1CCN(CC2CC2)CC1.CC(C)(C)CC12CCCN1CCC2.CC(C)CN1CCC(C(C)(C)C)CC1.CC(C)N1CCC(C(C)(C)C)CC1.CCN(C)CCOC(C)(C)C.CCN(CC)CCOC.CCN1CCC(C(C)(C)C)CC1.CN(C)CCN1CCC(C(C)(C)C)CC1.CN(C)CCOC(C)(C)C.CN1CC(C(C)(C)C)C1.CN1CCC(C(C)(C)C)CC1.CN1CCC(C)(C(C)(C)C)C1.CN1CCC(C)(C(C)(C)C)CC1.CN1CCC(CC(C)(C)C)CC1.CN1CCC(N2CCC(C(C)(C)C)CC2)CC1.CN1CCCC1C(C)(C)C.CN1CCN(C)C(CC(C)(C)C)C1	4-tert-butyl-1-(cyclopropylmethyl)piperidine;4-tert-butyl-1-cyclopropylpiperidine;4-tert-butyl-1,4-dimethylpiperidine;3-tert-butyl-1,3-dimethylpyrrolidine;4-tert-butyl-1-ethylpiperidine;3-tert-butyl-1-methylazetidine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-1-(1-methylpiperidin-4-yl)piperidine;4-tert-butyl-1-(2-methylpropyl)piperidine;2-tert-butyl-1-methylpyrrolidine;2-(4-tert-butylpiperidin-1-yl)-N,N-dimethylethanamine;4-tert-butyl-1-propan-2-ylpiperidine;N,N-diethyl-2-methoxyethanamine;N,N-dimethyl-2-[(2-methylpropan-2-yl)oxy]ethanamine;2-(2,2-dimethylpropyl)-1,4-dimethylpiperazine;8-(2,2-dimethylpropyl)-1,2,3,5,6,7-hexahydropyrrolizine;4-(2,2-dimethylpropyl)-1-methylpiperidine;N-ethyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine
COc1ccc(N=Nc2cc(CO)c(O)c(OC)c2)cc1	2-(hydroxymethyl)-6-methoxy-4-[(4-methoxyphenyl)diazenyl]phenol
CC(C)(C)OCCCCCC[Si](C)(C1CCC2C=CC=CC21)C1C(Cc2ccccc2)CC2C=CC=CC21	2,3,3a,7a-tetrahydro-1H-inden-1-yl-(2-benzyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-methyl-[6-[(2-methylpropan-2-yl)oxy]hexyl]silane
Cc1ccc2cc(CNc3ccc(C)c(C)c3)c(=O)[nH]c2c1	3-[(3,4-dimethylanilino)methyl]-7-methyl-1H-quinolin-2-one
COC(=O)NCCc1cc(F)cc(NC(=O)Nc2cccnc2)c1	methyl N-[2-[3-fluoro-5-(pyridin-3-ylcarbamoylamino)phenyl]ethyl]carbamate
CCS(=O)(=O)C1CSCCN1C1CC(N)c2ccccc21	3-(3-ethylsulfonylthiomorpholin-4-yl)-2,3-dihydro-1H-inden-1-amine
COc1ccc(C[C@@H]2NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H]3[C@@H]4CCN3C(=O)[C@@H]3Cc5cn(c6ccc(F)cc56)CCCCCCN(Cc5ccc(cc5)CCNC(=O)[C@]5(C)CCCN5C2=O)C(=O)CCC(=O)N[C@@H](C)C(=O)N[C@H](CCC(=O)CCOCCOCC[N+](C)(C)CCNC(=O)CCOCCOCC[N+](C)(C)CCNC(=O)COCCOCCNC(=O)COCCOCCCC(=O)CC[C@H](NC(=O)CC[C@H](CC(=O)CCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc2cccc(c2)CNC(=O)CO4)C(=O)N3)cc1.[CH3-].[CH3-]	carbanide;2-[[2-[2-[2-[[2-[2-[(7S)-7-carboxy-7-[[(4R)-4,20-dicarboxy-6-oxoicosanoyl]amino]-4-oxoheptoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethyl-[2-[2-[3-[2-[2-[2-[5-[(11S,17S,20S,23S,27S,39S,42S,63S,66R)-47-fluoro-20-[(1R)-1-hydroxyethyl]-17-[(4-methoxyphenyl)methyl]-11,63-dimethyl-10,16,19,22,30,40,58,61,64,67,70-undecaoxo-28-oxa-1,9,15,18,21,24,31,41,51,62,65,68-dodecazanonacyclo[37.18.11.23,6.124,42.133,37.144,51.011,15.023,27.045,50]triheptaconta-3(73),4,6(72),33,35,37(71),44(69),45(50),46,48-decaen-66-yl]-3-oxopentoxy]ethoxy]ethyl-dimethylazaniumyl]ethylamino]-3-oxopropoxy]ethoxy]ethyl]-dimethylazanium
N#C[C@@H]1OC(=O)O[C@H]1C(Br)(Br)Br	(4S,5R)-2-oxo-5-(tribromomethyl)-1,3-dioxolane-4-carbonitrile
CCC(C=C1OC(=O)C2=C(c3cccc(O)c3)C3CCC12C1C2=C(CCC31)C(=CCC(C)CO)OC2=O)CCC(C)C	16-(2-ethyl-5-methylhexylidene)-6-(4-hydroxy-3-methylbutylidene)-12-(3-hydroxyphenyl)-5,15-dioxapentacyclo[9.5.2.01,13.02,10.03,7]octadeca-3(7),12-diene-4,14-dione
CC(C)CN1CCc2nc(C3CCCCN3)sc2C1	5-(2-methylpropyl)-2-piperidin-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine
COc1ccc(COc2cc(-c3nn(C4CCCCO4)c4ccc([Sn](C)(C)C)cc34)nc(O[C@H]3CN(C(=O)OCc4ccccc4)CC[C@@H]3F)n2)cc1	benzyl (3S,4S)-4-fluoro-3-[4-[(4-methoxyphenyl)methoxy]-6-[1-(oxan-2-yl)-5-trimethylstannylindazol-3-yl]pyrimidin-2-yl]oxypiperidine-1-carboxylate
CCCCCC(=O)Oc1ccc(C[C@H](N)C(=O)O[C@@H](C)C(C)OC(=O)OCC)cc1OC(=O)CCCCC	[4-[(2S)-2-amino-3-[(2S)-3-ethoxycarbonyloxybutan-2-yl]oxy-3-oxopropyl]-2-hexanoyloxyphenyl] hexanoate
COc1c(Br)cc(C)c2c1CCC2	5-bromo-4-methoxy-7-methyl-2,3-dihydro-1H-indene
COc1cc2c(cc1OC)C(N(Cc1ccccc1)C(=O)CN1C(=O)c3ccccc3C1=O)C(Cc1ccccc1)CC2	N-benzyl-N-(2-benzyl-6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-(1,3-dioxoisoindol-2-yl)acetamide
O=S(=O)(NCC(F)(F)F)N1CCCC1C1CCCN1	2-pyrrolidin-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-sulfonamide
Cc1cccc(Cn2nc(C)c3c(CC(=O)c4cnc5cc(F)ccn45)cccc32)n1	1-(7-fluoroimidazo[1,2-a]pyridin-3-yl)-2-[3-methyl-1-[(6-methylpyridin-2-yl)methyl]indazol-4-yl]ethanone
CC(=N)N1CCC(Oc2ccc3c(c2)C(=C(C)C)C(=O)N3Cc2ccc3ccc(C(=N)N)cc3c2)CC1	7-[[5-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxo-3-propan-2-ylideneindol-1-yl]methyl]naphthalene-2-carboximidamide
COC(=O)c1cccc(C(=O)N[C@H]2CCCN(C3CCN(C)CC3)C2)c1	methyl 3-[[(3S)-1-(1-methylpiperidin-4-yl)piperidin-3-yl]carbamoyl]benzoate
O=C(c1ccccc1)C1C(c2ccc(Cl)cc2)C([N+](=O)[O-])C2C=Cc3ccccc3N21	[2-(4-chlorophenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl]-phenylmethanone
CC(=O)c1ccc(S(=O)(=O)N(C)CC(=O)Oc2ccc3ccccc3c2)cc1	naphthalen-2-yl 2-[(4-acetylphenyl)sulfonyl-methylamino]acetate
Cc1nc(C(=O)N(C)CC2CC=CCC2)ccc1C(=O)O	6-[cyclohex-3-en-1-ylmethyl(methyl)carbamoyl]-2-methylpyridine-3-carboxylic acid
C[C@@]12CC[C@@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@@H]1CC[C@H]2O	(3S,8R,9R,10R,13R,14S,17R)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
COC(=O)c1ccccc1NC(=O)Cn1c(C)c([N+](=O)[O-])ccc1=O	methyl 2-[[2-(2-methyl-3-nitro-6-oxopyridin-1-yl)acetyl]amino]benzoate
CC(C)Cc1cc(CNCCN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)nn1-c1ccccc1	N-[[5-(2-methylpropyl)-1-phenylpyrazol-3-yl]methyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamine
C[C@@H]1Cc2ccccc2N1C(=O)CNC[C@@H](c1ccccc1)N(C)C	2-[[(2R)-2-(dimethylamino)-2-phenylethyl]amino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
Cc1c(OCCCN2CCCCC2)cccc1-c1ccccc1Cl	1-[3-[3-(2-chlorophenyl)-2-methylphenoxy]propyl]piperidine
Br.CCCCCCCCCCCCCCCCNc1ccc(COC(C)=O)cc1.CCO	ethanol;[4-(hexadecylamino)phenyl]methyl acetate;hydrobromide
CCOC[C@@H]1C[C@H](OCC(=O)NCCNC(=O)C(F)(F)F)[C@H](n2cnc3c(N)ncnc32)O1	N-[2-[[2-[(2R,3S,5S)-2-(6-aminopurin-9-yl)-5-(ethoxymethyl)oxolan-3-yl]oxyacetyl]amino]ethyl]-2,2,2-trifluoroacetamide
COc1ccc([N+](=O)[O-])cc1C(=O)O[C@@H](C)C(=O)NC(=O)NC(C)(C)C	[(2S)-1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl] 2-methoxy-5-nitrobenzoate

CN1c2ccccc2Sc2oc[n+](N)c21

4-methyl-[1,3]oxazolo[5,4-b][1,4]benzothiazin-3-ium-3-amine

CCNCCCNC(=O)c1ccc(Nc2nc(NCc3ccc(OC)cc3)nc(OCC(F)(F)F)n2)cc1

N-[3-(ethylamino)propyl]-4-[[4-[(4-methoxyphenyl)methylamino]-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl]amino]benzamide

CCC1(CCC2CCCCS2)CCCCN1

2-ethyl-2-[2-(thian-2-yl)ethyl]piperidine

O=C(CN1CCC(C2OCCO2)CC1)Nc1ccc(Cl)c(C(F)(F)F)c1

N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(1,3-dioxolan-2-yl)piperidin-1-yl]acetamide

Cc1ccc(-c2ccc3c(c2)oc2ccccc23)cc1.Cc1ccc(-c2cccc3c2oc2ccccc23)cc1.Cc1ccc2c(c1)oc1cc(-c3ccccc3)ccc12.Cc1cccc(-c2ccc3c(c2)oc2ccccc23)c1.Cc1cccc(-c2cccc3c2oc2ccccc23)c1.Cc1ccccc1-c1ccc2c(c1)oc1ccccc12.Cc1ccccc1-c1ccc2oc3ccccc3c2c1

2-(2-methylphenyl)dibenzofuran;3-(2-methylphenyl)dibenzofuran;3-(3-methylphenyl)dibenzofuran;3-(4-methylphenyl)dibenzofuran;3-methyl-7-phenyldibenzofuran;4-(3-methylphenyl)dibenzofuran;4-(4-methylphenyl)dibenzofuran

Cc1cc(CN)cc(S(=O)(=O)NC(C)C(C)C)c1Br

5-(aminomethyl)-2-bromo-3-methyl-N-(3-methylbutan-2-yl)benzenesulfonamide

Cc1ccc(C)c(-c2nc(NC(=O)CCN)sc2C(C)C)c1

3-amino-N-[4-(2,5-dimethylphenyl)-5-propan-2-yl-1,3-thiazol-2-yl]propanamide

C=CCc1cccc2c1c1ccccc1n2-c1cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc(-n2c3ccccc3c3ccccc32)c1

9-[3-carbazol-9-yl-5-(3,5-diphenylphenyl)phenyl]-4-prop-2-enylcarbazole

C=CCn1c(SC(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c2ccccc2)nnc1C1CC1

N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(5-cyclopropyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenylacetamide

COc1cc(C#N)ccc1OCCCC(=O)NCCOc1ccccc1-c1ccccc1

4-(4-cyano-2-methoxyphenoxy)-N-[2-(2-phenylphenoxy)ethyl]butanamide

N#Cc1ccc(OCC(=O)N2CC[C@H]3CCCC[C@@H]3C2)cc1

4-[2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-oxoethoxy]benzonitrile

Cc1ccc(C#N)c(Nc2cccc(F)c2C)n1

2-(3-fluoro-2-methylanilino)-6-methylpyridine-3-carbonitrile

C/C=C\N(C)/N=C(\C)C(F)(F)F

(Z)-N-methyl-N-[(E)-1,1,1-trifluoropropan-2-ylideneamino]prop-1-en-1-amine

CC1(C)COC(C(Cc2ccccc2)C(=O)c2ccccc2)=N1

2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-1,3-diphenylpropan-1-one

Cc1cc(N2C(=O)c3oc4cc(C)c(C)cc4c(=O)c3[C@H]2c2cccnc2)no1

(1R)-6,7-dimethyl-2-(5-methyl-1,2-oxazol-3-yl)-1-pyridin-3-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione

CCc1ccc(SNC(C)(C)C=O)cc1

2-[(4-ethylphenyl)sulfanylamino]-2-methylpropanal

CC(CCC(=O)NCCN)C1CCC2C3C(O)CC4CCCCC4(C)C3CC(O)C12C

N-(2-aminoethyl)-4-(7,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamide

CCC(C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NC

N-butan-2-yl-2-(methylamino)-4-nitrobenzenesulfonamide

COc1cc(NC(=O)C(C)(C)C)c(C(=O)O)cc1OC

2-(2,2-dimethylpropanoylamino)-4,5-dimethoxybenzoic acid

COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1

(E)-3-[5-(2-chloro-5-nitrophenyl)furan-2-yl]-2-cyano-N-(2-methoxy-5-methylphenyl)prop-2-enamide

CCn1ncc(Cl)c1C(N)c1cccc(C)n1

(4-chloro-2-ethylpyrazol-3-yl)-(6-methylpyridin-2-yl)methanamine

CCOC(=O)C1=C(CSS(=O)(=O)c2ccc(C)cc2)NC(C)=C(C(=O)OC)C1c1cccc([N+](=O)[O-])c1

5-O-ethyl 3-O-methyl 2-methyl-6-[(4-methylphenyl)sulfonylsulfanylmethyl]-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

C/C(N)=C(/C=N)CO

(E)-3-amino-2-methanimidoylbut-2-en-1-ol

CCCCC[C@@H]1O[C@@H](O[C@H]2[C@H](OC([C@H]3COC(C)(C)O3)[C@@H]3OC(C)(C)O[C@H]3C(OC)OC)O[C@H](COC(=O)c3ccccc3)[C@@H]3OC(C)(C)O[C@@H]32)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1

[(3aS,4R,6S,7R,7aS)-6-[[(4S,5R)-5-(dimethoxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,2-dimethyl-7-[(2S,3S,4R,5R,6S)-6-pentyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-4-yl]methyl benzoate

CCC1CCC(Br)CC1C

4-bromo-1-ethyl-2-methylcyclohexane

O=C(CC1CC2CCC(C1)N2)N1CCCCO1

2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(oxazinan-2-yl)ethanone

CC(=O)Nc1cccc(C(=O)N/N=C\c2ccc(N(C)C)cc2)c1

3-acetamido-N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]benzamide

C=C(C)C(N)CC/C(C)=C/C

(6E)-2,6-dimethylocta-1,6-dien-3-amine

Cc1ccc(S(=O)(=O)CC(C)NC2c3ccccc3CC2O)cc1

1-[1-(4-methylphenyl)sulfonylpropan-2-ylamino]-2,3-dihydro-1H-inden-2-ol

C[Si](C)(C)N=C(N[Si](C)(C)C)c1c(F)cccc1F

2,6-difluoro-N,N'-bis(trimethylsilyl)benzenecarboximidamide

CCN1CCOC(CNCc2ccc(OC)c(F)c2)C1

1-(4-ethylmorpholin-2-yl)-N-[(3-fluoro-4-methoxyphenyl)methyl]methanamine

CC(C)c1cc(F)cc2c1cc1n2CCCC1CC(=O)O

2-(3-fluoro-1-propan-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]indol-9-yl)acetic acid

Nc1ccc(C(=O)N2CC[C@@H](c3c(C(=O)N4CCOCC4)sc4ncccc34)C2)cn1

(6-aminopyridin-3-yl)-[(3S)-3-[2-(morpholine-4-carbonyl)thieno[2,3-b]pyridin-3-yl]pyrrolidin-1-yl]methanone

CC(C)(NCc1ccc(C#N)cc1)C(N)c1ccnc2cc(Cl)ccc12

4-[[[1-amino-1-(7-chloroquinolin-4-yl)-2-methylpropan-2-yl]amino]methyl]benzonitrile

CS(=O)(=O)c1cccc(Oc2nc(N[C@H]3CCCNC3)ncc2C(F)(F)F)c1

4-(3-methylsulfonylphenoxy)-N-[(3S)-piperidin-3-yl]-5-(trifluoromethyl)pyrimidin-2-amine

c1ccc(-c2cc(-n3c4ccc(-c5ccc6ccccc6c5)cc4c4cc5c6cc(-c7ccc8ccccc8c7)ccc6c6ccccc6c5cc43)cc(-c3ccccc3)n2)cc1

23-(2,6-diphenylpyridin-4-yl)-11,19-dinaphthalen-2-yl-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8(13),9,11,14,16(24),17(22),18,20-dodecaene

C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)N=C=S

(2R)-2-(2,4-dichlorophenoxy)propanoyl isothiocyanate

COc1ccccc1NC(=O)C1CC1C(=O)N(C)CCc1ccncc1

2-N-(2-methoxyphenyl)-1-N-methyl-1-N-(2-pyridin-4-ylethyl)cyclopropane-1,2-dicarboxamide

CC[C@@H]1CN(Cc2cc(C(c3ccc4c(nnn4CC)c3C)C(C)(C)C(=O)NCC(N)=O)ccc2C)S(=O)(=O)c2ccccc2O1

N-(2-amino-2-oxoethyl)-3-[3-[[(4R)-4-ethyl-1,1-dioxo-3,4-dihydro-5,1λ6,2-benzoxathiazepin-2-yl]methyl]-4-methylphenyl]-3-(1-ethyl-4-methylbenzotriazol-5-yl)-2,2-dimethylpropanamide

Cn1c(SCc2nnsc2NN)n[nH]c1=O

3-[(5-hydrazinylthiadiazol-4-yl)methylsulfanyl]-4-methyl-1H-1,2,4-triazol-5-one

Cc1ccc(NC(=O)COc2c(Cl)cc(C3C4=C(CC(C)(C)CC4=O)OC4=C3C(=O)CC(C)(C)C4)cc2Cl)cc1

2-[2,6-dichloro-4-(3,3,6,6-tetramethyl-1,8-dioxo-4,5,7,9-tetrahydro-2H-xanthen-9-yl)phenoxy]-N-(4-methylphenyl)acetamide

C#CC(/C(C)=C\C(=C/C)C1=C(C)C(CC)CC=C1C)/C(=C\C)c1ccc(C2OC2C)cc1

2-[4-[(2E,5Z,7E)-7-(3-ethyl-2,6-dimethylcyclohexa-1,5-dien-1-yl)-4-ethynyl-5-methylnona-2,5,7-trien-3-yl]phenyl]-3-methyloxirane

CNc1ccc2c(c1)N(CCC(=O)OC)C(=O)CO2

methyl 3-[6-(methylamino)-3-oxo-1,4-benzoxazin-4-yl]propanoate

CC1NCCCC1NC(=O)CC(N)c1ccccc1

3-amino-N-(2-methylpiperidin-3-yl)-3-phenylpropanamide

CC(=O)Nc1ncc(S(=O)(=O)N2CCN(c3cc(C)nc(NC4CCCCC4)n3)CC2)s1

N-[5-[4-[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]piperazin-1-yl]sulfonyl-1,3-thiazol-2-yl]acetamide

O=C(NCc1ccccc1CN1CCOCC1)c1cccc(OC[C@@H]2CCCO2)c1

N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-3-[[(2S)-oxolan-2-yl]methoxy]benzamide

COc1ccc(CNC(=O)[C@@H]2CN(C)CC[C@@H]2O)cc1F.O=CO

(3R,4S)-N-[(3-fluoro-4-methoxyphenyl)methyl]-4-hydroxy-1-methylpiperidine-3-carboxamide;formic acid

CC1(C)c2ccc([nH]2)-c2ccc([nH]2)C(C)(C)c2ccc(s2)C(C)(C)c2ccc([nH]2)-c2ccc([nH]2)C(C)(C)c2ccc1s2

6,6,11,11,20,20,25,25-octamethyl-30,33-dithia-29,31,32,34-tetrazaheptacyclo[24.2.1.12,5.17,10.112,15.116,19.121,24]tetratriaconta-1(28),2,4,7,9,12,14,16,18,21,23,26-dodecaene

C[C@H](CCC(=O)NCS(=O)(=O)[O-])[C@H]1CCC2C3C(CC[C@@]21C)[C@@]1(C)CC(F)(F)[C@H](O)C[C@H]1C[C@@H]3O.C[C@H](CCC(=O)O)[C@H]1CCC2C3C(CC[C@@]21C)[C@@]1(C)CC(F)(F)[C@H](O)C[C@H]1C[C@@H]3O.[Na+]

sodium;(4R)-4-[(3R,5R,7S,10S,13R,17R)-2,2-difluoro-3,7-dihydroxy-10,13-dimethyl-1,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid;[[(4R)-4-[(3R,5R,7S,10S,13R,17R)-2,2-difluoro-3,7-dihydroxy-10,13-dimethyl-1,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoyl]amino]methanesulfonate

Cc1nc(NC2CCC(C)C(C)C2)ccc1C(=O)O

6-[(3,4-dimethylcyclohexyl)amino]-2-methylpyridine-3-carboxylic acid

CC(C)=NNC(=O)c1cc(-c2ccc([N+](=O)[O-])s2)nc2ccccc12

2-(5-nitrothiophen-2-yl)-N-(propan-2-ylideneamino)quinoline-4-carboxamide

COC(CCCCCCCCC(=O)[O-])CC(=O)[O-]

3-methoxydodecanedioate

COc1cccc(CN2CCc3nc(Nc4ccccc4)ncc3C2)c1OC

6-[(2,3-dimethoxyphenyl)methyl]-N-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine

CN(CCCNC(=O)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1)c1ccccc1

5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[3-(N-methylanilino)propyl]furan-2-carboxamide

CNC(=S)NCCCCC(NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12)C(=O)NC(CC(C)C)[C@@H](O)CC(=O)N(C)OC

(3S)-3-hydroxy-N-methoxy-N,6-dimethyl-4-[[6-(methylcarbamothioylamino)-2-[[3-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoyl]amino]hexanoyl]amino]heptanamide

Cc1cc(NCCCNS(C)(=O)=O)c(C(N)=S)c(C)n1

4-[3-(methanesulfonamido)propylamino]-2,6-dimethylpyridine-3-carbothioamide

O=C(/C=C/c1cccc(Cl)c1)OCC(=O)c1ccc(C2CCCCC2)cc1

[2-(4-cyclohexylphenyl)-2-oxoethyl] (E)-3-(3-chlorophenyl)prop-2-enoate

CC(C)c1cccc(-c2ncco2)c1F

2-(2-fluoro-3-propan-2-ylphenyl)-1,3-oxazole

CCCC=CC(CC)CCCPCC

ethyl(4-ethylnon-5-enyl)phosphane

CN=C(NCC1CCOc2ccccc21)N1CCN(CC(C)C)CC1

N-(3,4-dihydro-2H-chromen-4-ylmethyl)-N'-methyl-4-(2-methylpropyl)piperazine-1-carboximidamide

O=C1COc2ccc(OC(=O)c3ccccc3F)cc2N1

(3-oxo-4H-1,4-benzoxazin-6-yl) 2-fluorobenzoate

O=C(NCCSCc1c(F)cccc1Cl)c1ccccc1

N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]benzamide

N#Cc1c(C(F)(F)F)cc(C2=NN(c3cc(C(F)(F)F)c(C#N)c(C(F)(F)F)c3)C(O)C2C(OCCCCI)C(F)(F)F)cc1C(F)(F)F

4-[2-[4-cyano-3,5-bis(trifluoromethyl)phenyl]-3-hydroxy-4-[2,2,2-trifluoro-1-(4-iodobutoxy)ethyl]-3,4-dihydropyrazol-5-yl]-2,6-bis(trifluoromethyl)benzonitrile

CC(C)c1c(S(=O)(=O)N(Cc2ccccc2)S(C)(=O)=O)c(-c2ccc(F)cc2)c(-c2ccc(F)cc2)n1CCC(O)CC(O)CC(=O)O

7-[4-[benzyl(methylsulfonyl)sulfamoyl]-2,3-bis(4-fluorophenyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid

CN(C)C(CNC(=O)C1C2CCC(C2)C1N)c1ccccc1.Cl.Cl

3-amino-N-[2-(dimethylamino)-2-phenylethyl]bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride

COC(=O)c1ccc2ccn(Cc3cccc(CS(=O)(=O)c4ccccc4)c3)c2c1.COC(=O)c1ccc2ccn(Cc3cccc(N)c3)c2c1.O=S(=O)(Cl)c1ccccc1

benzenesulfonyl chloride;methyl 1-[(3-aminophenyl)methyl]indole-6-carboxylate;methyl 1-[[3-(benzenesulfonylmethyl)phenyl]methyl]indole-6-carboxylate

Cc1ccc(NC(=O)/C=C/C23CCC4C(CCC5C4(C)CCC4C(C)(C)C(OC(=O)CC(C)(C)C=O)CCC45C)C2=C(C(C)C)C(=O)C3)cc1

[5b,8,8,11a-tetramethyl-3a-[(E)-3-(4-methylanilino)-3-oxoprop-1-enyl]-2-oxo-1-propan-2-yl-3,4,5,5a,6,7,7a,9,10,11,11b,12,13,13a-tetradecahydrocyclopenta[a]chrysen-9-yl] 3,3-dimethyl-4-oxobutanoate

O=c1ccnc2ocnn12

[1,3,4]oxadiazolo[3,2-a]pyrimidin-5-one

Cc1cc(=O)[nH]c(CCNC(=O)C(C)(C)N2CCCC2)n1

2-methyl-N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-pyrrolidin-1-ylpropanamide

CCc1csc(C2CCCC(C)C2)n1

4-ethyl-2-(3-methylcyclohexyl)-1,3-thiazole

COc1cc2c(cc1NC(=O)[C@@H](C)Oc1nnc3ccccn13)oc1ccccc12

(2R)-N-(2-methoxydibenzofuran-3-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-yloxy)propanamide

CC(C)(C)C1CCN(C2CC2)CC1.CC(C)(C)C1CCN(CC2CC2)CC1.CC(C)(C)CC12CCCN1CCC2.CC(C)CN1CCC(C(C)(C)C)CC1.CC(C)N1CCC(C(C)(C)C)CC1.CCN(C)CCOC(C)(C)C.CCN(CC)CCOC.CCN1CCC(C(C)(C)C)CC1.CN(C)CCN1CCC(C(C)(C)C)CC1.CN(C)CCOC(C)(C)C.CN1CC(C(C)(C)C)C1.CN1CCC(C(C)(C)C)CC1.CN1CCC(C)(C(C)(C)C)C1.CN1CCC(C)(C(C)(C)C)CC1.CN1CCC(CC(C)(C)C)CC1.CN1CCC(N2CCC(C(C)(C)C)CC2)CC1.CN1CCCC1C(C)(C)C.CN1CCN(C)C(CC(C)(C)C)C1

4-tert-butyl-1-(cyclopropylmethyl)piperidine;4-tert-butyl-1-cyclopropylpiperidine;4-tert-butyl-1,4-dimethylpiperidine;3-tert-butyl-1,3-dimethylpyrrolidine;4-tert-butyl-1-ethylpiperidine;3-tert-butyl-1-methylazetidine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-1-(1-methylpiperidin-4-yl)piperidine;4-tert-butyl-1-(2-methylpropyl)piperidine;2-tert-butyl-1-methylpyrrolidine;2-(4-tert-butylpiperidin-1-yl)-N,N-dimethylethanamine;4-tert-butyl-1-propan-2-ylpiperidine;N,N-diethyl-2-methoxyethanamine;N,N-dimethyl-2-[(2-methylpropan-2-yl)oxy]ethanamine;2-(2,2-dimethylpropyl)-1,4-dimethylpiperazine;8-(2,2-dimethylpropyl)-1,2,3,5,6,7-hexahydropyrrolizine;4-(2,2-dimethylpropyl)-1-methylpiperidine;N-ethyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine

COc1ccc(N=Nc2cc(CO)c(O)c(OC)c2)cc1

2-(hydroxymethyl)-6-methoxy-4-[(4-methoxyphenyl)diazenyl]phenol

CC(C)(C)OCCCCCC[Si](C)(C1CCC2C=CC=CC21)C1C(Cc2ccccc2)CC2C=CC=CC21

2,3,3a,7a-tetrahydro-1H-inden-1-yl-(2-benzyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-methyl-[6-[(2-methylpropan-2-yl)oxy]hexyl]silane

Cc1ccc2cc(CNc3ccc(C)c(C)c3)c(=O)[nH]c2c1

3-[(3,4-dimethylanilino)methyl]-7-methyl-1H-quinolin-2-one

COC(=O)NCCc1cc(F)cc(NC(=O)Nc2cccnc2)c1

methyl N-[2-[3-fluoro-5-(pyridin-3-ylcarbamoylamino)phenyl]ethyl]carbamate

CCS(=O)(=O)C1CSCCN1C1CC(N)c2ccccc21

3-(3-ethylsulfonylthiomorpholin-4-yl)-2,3-dihydro-1H-inden-1-amine

COc1ccc(C[C@@H]2NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H]3[C@@H]4CCN3C(=O)[C@@H]3Cc5cn(c6ccc(F)cc56)CCCCCCN(Cc5ccc(cc5)CCNC(=O)[C@]5(C)CCCN5C2=O)C(=O)CCC(=O)N[C@@H](C)C(=O)N[C@H](CCC(=O)CCOCCOCC[N+](C)(C)CCNC(=O)CCOCCOCC[N+](C)(C)CCNC(=O)COCCOCCNC(=O)COCCOCCCC(=O)CC[C@H](NC(=O)CC[C@H](CC(=O)CCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc2cccc(c2)CNC(=O)CO4)C(=O)N3)cc1.[CH3-].[CH3-]

carbanide;2-[[2-[2-[2-[[2-[2-[(7S)-7-carboxy-7-[[(4R)-4,20-dicarboxy-6-oxoicosanoyl]amino]-4-oxoheptoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethyl-[2-[2-[3-[2-[2-[2-[5-[(11S,17S,20S,23S,27S,39S,42S,63S,66R)-47-fluoro-20-[(1R)-1-hydroxyethyl]-17-[(4-methoxyphenyl)methyl]-11,63-dimethyl-10,16,19,22,30,40,58,61,64,67,70-undecaoxo-28-oxa-1,9,15,18,21,24,31,41,51,62,65,68-dodecazanonacyclo[37.18.11.23,6.124,42.133,37.144,51.011,15.023,27.045,50]triheptaconta-3(73),4,6(72),33,35,37(71),44(69),45(50),46,48-decaen-66-yl]-3-oxopentoxy]ethoxy]ethyl-dimethylazaniumyl]ethylamino]-3-oxopropoxy]ethoxy]ethyl]-dimethylazanium

N#C[C@@H]1OC(=O)O[C@H]1C(Br)(Br)Br

(4S,5R)-2-oxo-5-(tribromomethyl)-1,3-dioxolane-4-carbonitrile

CCC(C=C1OC(=O)C2=C(c3cccc(O)c3)C3CCC12C1C2=C(CCC31)C(=CCC(C)CO)OC2=O)CCC(C)C

16-(2-ethyl-5-methylhexylidene)-6-(4-hydroxy-3-methylbutylidene)-12-(3-hydroxyphenyl)-5,15-dioxapentacyclo[9.5.2.01,13.02,10.03,7]octadeca-3(7),12-diene-4,14-dione

CC(C)CN1CCc2nc(C3CCCCN3)sc2C1

5-(2-methylpropyl)-2-piperidin-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine

COc1ccc(COc2cc(-c3nn(C4CCCCO4)c4ccc([Sn](C)(C)C)cc34)nc(O[C@H]3CN(C(=O)OCc4ccccc4)CC[C@@H]3F)n2)cc1

benzyl (3S,4S)-4-fluoro-3-[4-[(4-methoxyphenyl)methoxy]-6-[1-(oxan-2-yl)-5-trimethylstannylindazol-3-yl]pyrimidin-2-yl]oxypiperidine-1-carboxylate

CCCCCC(=O)Oc1ccc(C[C@H](N)C(=O)O[C@@H](C)C(C)OC(=O)OCC)cc1OC(=O)CCCCC

[4-[(2S)-2-amino-3-[(2S)-3-ethoxycarbonyloxybutan-2-yl]oxy-3-oxopropyl]-2-hexanoyloxyphenyl] hexanoate

COc1c(Br)cc(C)c2c1CCC2

5-bromo-4-methoxy-7-methyl-2,3-dihydro-1H-indene

COc1cc2c(cc1OC)C(N(Cc1ccccc1)C(=O)CN1C(=O)c3ccccc3C1=O)C(Cc1ccccc1)CC2

N-benzyl-N-(2-benzyl-6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-(1,3-dioxoisoindol-2-yl)acetamide

O=S(=O)(NCC(F)(F)F)N1CCCC1C1CCCN1

2-pyrrolidin-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-sulfonamide

Cc1cccc(Cn2nc(C)c3c(CC(=O)c4cnc5cc(F)ccn45)cccc32)n1

1-(7-fluoroimidazo[1,2-a]pyridin-3-yl)-2-[3-methyl-1-[(6-methylpyridin-2-yl)methyl]indazol-4-yl]ethanone

CC(=N)N1CCC(Oc2ccc3c(c2)C(=C(C)C)C(=O)N3Cc2ccc3ccc(C(=N)N)cc3c2)CC1

7-[[5-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxo-3-propan-2-ylideneindol-1-yl]methyl]naphthalene-2-carboximidamide

COC(=O)c1cccc(C(=O)N[C@H]2CCCN(C3CCN(C)CC3)C2)c1

methyl 3-[[(3S)-1-(1-methylpiperidin-4-yl)piperidin-3-yl]carbamoyl]benzoate

O=C(c1ccccc1)C1C(c2ccc(Cl)cc2)C([N+](=O)[O-])C2C=Cc3ccccc3N21

[2-(4-chlorophenyl)-3-nitro-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-1-yl]-phenylmethanone

CC(=O)c1ccc(S(=O)(=O)N(C)CC(=O)Oc2ccc3ccccc3c2)cc1

naphthalen-2-yl 2-[(4-acetylphenyl)sulfonyl-methylamino]acetate

Cc1nc(C(=O)N(C)CC2CC=CCC2)ccc1C(=O)O

6-[cyclohex-3-en-1-ylmethyl(methyl)carbamoyl]-2-methylpyridine-3-carboxylic acid

C[C@@]12CC[C@@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@@H]1CC[C@H]2O

(3S,8R,9R,10R,13R,14S,17R)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol

COC(=O)c1ccccc1NC(=O)Cn1c(C)c([N+](=O)[O-])ccc1=O

methyl 2-[[2-(2-methyl-3-nitro-6-oxopyridin-1-yl)acetyl]amino]benzoate

CC(C)Cc1cc(CNCCN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)nn1-c1ccccc1

N-[[5-(2-methylpropyl)-1-phenylpyrazol-3-yl]methyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamine

C[C@@H]1Cc2ccccc2N1C(=O)CNC[C@@H](c1ccccc1)N(C)C

2-[[(2R)-2-(dimethylamino)-2-phenylethyl]amino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone

Cc1c(OCCCN2CCCCC2)cccc1-c1ccccc1Cl

1-[3-[3-(2-chlorophenyl)-2-methylphenoxy]propyl]piperidine

Br.CCCCCCCCCCCCCCCCNc1ccc(COC(C)=O)cc1.CCO

ethanol;[4-(hexadecylamino)phenyl]methyl acetate;hydrobromide

CCOC[C@@H]1C[C@H](OCC(=O)NCCNC(=O)C(F)(F)F)[C@H](n2cnc3c(N)ncnc32)O1

N-[2-[[2-[(2R,3S,5S)-2-(6-aminopurin-9-yl)-5-(ethoxymethyl)oxolan-3-yl]oxyacetyl]amino]ethyl]-2,2,2-trifluoroacetamide

COc1ccc([N+](=O)[O-])cc1C(=O)O[C@@H](C)C(=O)NC(=O)NC(C)(C)C

[(2S)-1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl] 2-methoxy-5-nitrobenzoate