AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-41

SMILES stringlengths 2 803	IUPAC stringlengths 4 1.45k
C[C@H](CCOCc1ccccc1)[C@H](O)CCO	(3R,4R)-4-methyl-6-phenylmethoxyhexane-1,3-diol
COc1cccc(-c2ccn(CCN)n2)c1	2-[3-(3-methoxyphenyl)pyrazol-1-yl]ethanamine
CCCC1CCN(c2ccccc2CNCC)C1	N-[[2-(3-propylpyrrolidin-1-yl)phenyl]methyl]ethanamine
CCc1ccc(CN(C)Cc2ccccc2)cc1	N-[(4-ethylphenyl)methyl]-N-methyl-1-phenylmethanamine
C[N+](C)(C)CCO.C[N+](C)(C)CCO.O=C([O-])C(O)C(O)C(=O)[O-]	2,3-dihydroxybutanedioate;2-hydroxyethyl(trimethyl)azanium
COc1cccc([C@@H]2CN(C(=O)c3ccccc3F)C[C@@H]2C(=O)NCC2CC2)c1	(3R,4R)-N-(cyclopropylmethyl)-1-(2-fluorobenzoyl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide
O=c1[nH]c2cc(Br)c([N+](=O)[O-])cc2[nH]1	5-bromo-6-nitro-1,3-dihydrobenzimidazol-2-one
c1ccc(-c2cc3ccccc3cc2N(c2ccc3ccccc3c2)c2ccc3c4c(cccc24)C2(c4ccccc4Sc4ccccc42)c2ccccc2-3)cc1	N-naphthalen-2-yl-N-(3-phenylnaphthalen-2-yl)spiro[benzo[a]phenalene-7,9'-thioxanthene]-3-amine
CC1(C)OB(c2ccc3c(ccc4c5ccccc5sc34)c2)OC1(C)C	4,4,5,5-tetramethyl-2-naphtho[1,2-b][1]benzothiol-3-yl-1,3,2-dioxaborolane
CC1(C)N=C(N)N=C(N)N1OCCSCCON1C(N)=NC(N)=NC1(C)C	1-[2-[2-[(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)oxy]ethylsulfanyl]ethoxy]-6,6-dimethyl-1,3,5-triazine-2,4-diamine
CC1(C)COC2=CN(C3CC4CC3CN4)CC=C21	6-(2-azabicyclo[2.2.1]heptan-5-yl)-3,3-dimethyl-2,5-dihydrofuro[2,3-c]pyridine
COc1ccc(-c2c(C(N)=O)nc(N3CCC(N)CC3)nc2-c2ccc(C#N)c(F)c2)cc1F	2-(4-aminopiperidin-1-yl)-6-(4-cyano-3-fluorophenyl)-5-(3-fluoro-4-methoxyphenyl)pyrimidine-4-carboxamide
CC.CC(=O)N1CC2(C1)CN(c1ccc(F)cn1)C2	ethane;1-[6-(5-fluoropyridin-2-yl)-2,6-diazaspiro[3.3]heptan-2-yl]ethanone
Cc1nc(CN2CCOC(C(=O)O)C2)oc1C	4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholine-2-carboxylic acid
CC(C)(CC1CC2CCC1CC2)OCCC1CCCCC1.CC(C)OC(C)(C)CC1CCCCC1	2-[2-(2-cyclohexylethoxy)-2-methylpropyl]bicyclo[2.2.2]octane;(2-methyl-2-propan-2-yloxypropyl)cyclohexane
NP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-]	amino-[oxido(phosphonatooxy)phosphoryl]oxyphosphinate
CCc1ccc[c-]1C(C)(C)[c-]1cccc1CC.[Fe+2].[Fe+2].c1cc[cH-]c1.c1cc[cH-]c1	cyclopenta-1,3-diene;1-ethyl-5-[2-(2-ethylcyclopenta-2,4-dien-1-yl)propan-2-yl]cyclopenta-1,3-diene;iron(2+)
COC1CCN(Cc2ccc(Cl)nc2Cl)C(CN)C1	[1-[(2,6-dichloropyridin-3-yl)methyl]-4-methoxypiperidin-2-yl]methanamine
Cc1cc2occ(CC(=O)Nc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)c2cc1C	2-(5,6-dimethyl-1-benzofuran-3-yl)-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]acetamide
CCCN(Cc1ccc(Br)cn1)C1CNC1	N-[(5-bromopyridin-2-yl)methyl]-N-propylazetidin-3-amine
Cc1ncc(CNc2ccc(Sc3ncn[nH]3)cc2)s1	N-[(2-methyl-1,3-thiazol-5-yl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline
CCN(c1ccnc(C(=O)NC)c1)C1CCC(N)CC1	4-[(4-aminocyclohexyl)-ethylamino]-N-methylpyridine-2-carboxamide
C=CCc1ccc(OCCn2cc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)c3ccccc32)c(OC)c1	1-(4-fluorophenyl)-5-[[1-[2-(2-methoxy-4-prop-2-enylphenoxy)ethyl]indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione
CC(C)CC(=O)CC1CCc2cc(-c3noc(C(F)F)n3)ccc21	1-[5-[5-(difluoromethyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]-4-methylpentan-2-one
O=C(CI)NNC(=O)NC(=O)c1ccccc1	N-[[(2-iodoacetyl)amino]carbamoyl]benzamide
O=C(Nc1cc(Cl)c(-c2ccnc(F)c2)cc1F)N1[C@H]2CC[C@@H]1c1n[nH]c(=O)cc1C2	(1R,9S)-N-[5-chloro-2-fluoro-4-(2-fluoropyridin-4-yl)phenyl]-5-oxo-3,4,12-triazatricyclo[7.2.1.02,7]dodeca-2,6-diene-12-carboxamide
Clc1c[nH]c2nccc(-c3ccc4c(c3)OCO4)c12	4-(1,3-benzodioxol-5-yl)-3-chloro-1H-pyrrolo[2,3-b]pyridine
C=C/C(C#N)=C\C=C(/CCn1cc[n+](C)c1CO)[C@@H]1C(C(=O)OC)=C(C)N(c2cccc(C(F)(F)F)c2)c2n[nH]c(=O)n21.COC=O	methyl (5R)-5-[(3E,5E)-6-cyano-1-[2-(hydroxymethyl)-3-methylimidazol-3-ium-1-yl]octa-3,5,7-trien-3-yl]-7-methyl-3-oxo-8-[3-(trifluoromethyl)phenyl]-2,5-dihydro-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylate;methyl formate
CN(C(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O)C1CCS(=O)(=O)C1	2-(3-chloro-N-methylsulfonylanilino)-N-(1,1-dioxothiolan-3-yl)-N-methylacetamide
CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)(O)CCC1=C(C)C(=O)C=C(C)C1=O.CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)(O)CCC1=CC(=O)C(C)=C(C)C1=O.CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)(O)CCC1=CC(=O)C=C(C)C1=O	3-[(6E,10E)-3-hydroxy-3,7,11,15-tetramethylhexadeca-6,10,14-trienyl]-2,5-dimethylcyclohexa-2,5-diene-1,4-dione;5-[(6E,10E)-3-hydroxy-3,7,11,15-tetramethylhexadeca-6,10,14-trienyl]-2,3-dimethylcyclohexa-2,5-diene-1,4-dione;2-[(6E,10E)-3-hydroxy-3,7,11,15-tetramethylhexadeca-6,10,14-trienyl]-6-methylcyclohexa-2,5-diene-1,4-dione
COc1ccc2c(c1)c(C=O)cn2CCCI	1-(3-iodopropyl)-5-methoxyindole-3-carbaldehyde
COc1ccc(I(OC(C)=O)OC(C)=O)c2c1CCC[C@H]2OC(=O)C(C)(C)C	[(1R)-8-(diacetyloxy-λ3-iodanyl)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl] 2,2-dimethylpropanoate
CCC(C)(C)NC(=O)C(c1ccccc1Cl)N(C(=O)Cn1nnc2ccccc21)c1cccc(C(C)=O)c1	2-(3-acetyl-N-[2-(benzotriazol-1-yl)acetyl]anilino)-2-(2-chlorophenyl)-N-(2-methylbutan-2-yl)acetamide
CNc1nc(Nc2cn(Cc3cccc(C)n3)nc2C)ncc1C(F)(F)F	4-N-methyl-2-N-[3-methyl-1-[(6-methylpyridin-2-yl)methyl]pyrazol-4-yl]-5-(trifluoromethyl)pyrimidine-2,4-diamine
COc1ccc(OC)c(C(=O)Nc2ccc(Br)cc2C(=O)c2ccccc2Cl)c1	N-[4-bromo-2-(2-chlorobenzoyl)phenyl]-2,5-dimethoxybenzamide
O=C(O)CC1(NC(=O)c2c[nH]ccc2=O)CCC1	2-[1-[(4-oxo-1H-pyridine-3-carbonyl)amino]cyclobutyl]acetic acid
CC#CCCNC(CN)c1ccc(C)c(Cl)c1	1-(3-chloro-4-methylphenyl)-N-pent-3-ynylethane-1,2-diamine
CCc1ccc(Cc2ccc(COC(C)=O)cc2OC2O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]2O)cc1	[(2R,3S,4S,5R)-6-[5-(acetyloxymethyl)-2-[(4-ethylphenyl)methyl]phenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl acetate
O=C(c1cccs1)N1CCCN(c2nc3c(cnn3-c3ccccc3)c(=O)[nH]2)CC1	1-phenyl-6-[4-(thiophene-2-carbonyl)-1,4-diazepan-1-yl]-5H-pyrazolo[3,4-d]pyrimidin-4-one
C[C@@H](CCCC(N)=O)C[C@H](OC(=O)[C@H](C)CC/C=C/I)C(C)(C)C	[(3S,5S)-9-amino-2,2,5-trimethyl-9-oxononan-3-yl] (E,2R)-6-iodo-2-methylhex-5-enoate
NCCc1ccc(S(=O)(=O)N2CCS(=O)CC2)cc1	2-[4-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]phenyl]ethanamine
CCNC(C1=CCCCC1)C1CCC(CC)C1	N-[cyclohexen-1-yl-(3-ethylcyclopentyl)methyl]ethanamine
O=C(O)C[C@H](NC(=O)[C@@H]1CCCN(CCCc2ccc3c(n2)NCCC3)C1)c1cccc([C@@H]2CCOC2)c1	(3S)-3-[3-[(3S)-oxolan-3-yl]phenyl]-3-[[(3R)-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidine-3-carbonyl]amino]propanoic acid
Cc1cnn(-c2ccccc2C2(C)CCCN2)n1	4-methyl-2-[2-(2-methylpyrrolidin-2-yl)phenyl]triazole
c1ccc(-c2cc(-c3ccc(-n4c5cc6ccsc6cc5c5c6ccccc6c6ccccc6c54)cc3)nc(-c3ccccc3)n2)cc1	24-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-18-thia-24-azahexacyclo[12.10.0.02,7.08,13.015,23.017,21]tetracosa-1(14),2,4,6,8,10,12,15(23),16,19,21-undecaene
Cc1cc(Cn2cc3c(NC(=O)C(C)C)nccc3n2)cnc1OCc1ccc(F)cc1	N-[2-[[6-[(4-fluorophenyl)methoxy]-5-methylpyridin-3-yl]methyl]pyrazolo[4,3-c]pyridin-4-yl]-2-methylpropanamide
NCC(CO)c1c[nH]c2ncccc12	3-amino-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)propan-1-ol
CCNc1cc(C(=O)Nc2nc(C(C)C)cs2)c(Cl)cn1	5-chloro-2-(ethylamino)-N-(4-propan-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide
C=CCOc1cccc([C@@H]2/C(=C(\O)c3ccc4c(c3)C[C@H](C)O4)C(=O)C(=O)N2c2nc(C)c(C(=O)OC)s2)c1	methyl 2-[(4E,5R)-4-[hydroxy-[(2S)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]methylidene]-2,3-dioxo-5-(3-prop-2-enoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
CCOc1cn(-c2ccc(F)cc2C(C)C)nc1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1	N-[5-(6,7-dimethoxyquinolin-4-yl)oxypyridin-2-yl]-4-ethoxy-1-(4-fluoro-2-propan-2-ylphenyl)pyrazole-3-carboxamide
CCc1nn2c(c1-c1c(Cl)ccc3c(CCCOc4cccc5cc(F)ccc45)c(C(=O)O)n(CCN4CCNCC4)c13)COCC2.Cl	6-chloro-7-(2-ethyl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazin-3-yl)-3-[3-(6-fluoronaphthalen-1-yl)oxypropyl]-1-(2-piperazin-1-ylethyl)indole-2-carboxylic acid;hydrochloride
Nc1ncc2c(n1)CN(S(=O)(=O)c1ccc(C(F)(F)F)cc1)CC2	7-[4-(trifluoromethyl)phenyl]sulfonyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine
CC(=O)Nc1cc(-c2[nH]c3cc(OC4COC4)cnc3c2-c2cccc(C(F)F)n2)ccn1	N-[4-[3-[6-(difluoromethyl)pyridin-2-yl]-6-(oxetan-3-yloxy)-1H-pyrrolo[3,2-b]pyridin-2-yl]pyridin-2-yl]acetamide
CC[C@H](C)NC(=O)[C@H](CC)N(Cc1ccc(Cl)cc1Cl)C(=O)CN(c1cc(C)ccc1OC)S(C)(=O)=O	(2S)-N-[(2S)-butan-2-yl]-2-[(2,4-dichlorophenyl)methyl-[2-(2-methoxy-5-methyl-N-methylsulfonylanilino)acetyl]amino]butanamide
Cc1cc(-c2ccc(C(=O)CS(=O)(=O)c3cccc(N)n3)c(N3C[C@@H](C)CC3(C)C)n2)cnc1OCCOC(C)C.[HH].[HH]	2-(6-aminopyridin-2-yl)sulfonyl-1-[6-[5-methyl-6-(2-propan-2-yloxyethoxy)pyridin-3-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridin-3-yl]ethanone;molecular hydrogen
C1CCNCC1.Cn1cc(-c2cc(Sc3cccc4cn[nH]c34)c3c(C#N)cnn3c2)cn1	4-(1H-indazol-7-ylsulfanyl)-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;piperidine
CC(=O)NC(C(=O)Oc1ccc(N(C)C(=O)c2ccc(C)cc2)cc1)C1CCCC1	[4-[methyl-(4-methylbenzoyl)amino]phenyl] 2-acetamido-2-cyclopentylacetate
Cc1cccc(C)c1NC(=O)C[NH+](C)CC(=O)Nc1ccc2c(c1)OC(F)(F)O2	[2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl]-[2-(2,6-dimethylanilino)-2-oxoethyl]-methylazanium
COC(=O)C(Nc1cncc(NN)n1)C(C)C	methyl 2-[(6-hydrazinylpyrazin-2-yl)amino]-3-methylbutanoate
C=CCNc1nc(N2CCN(c3ccccn3)CC2)nc2ccccc12	N-prop-2-enyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinazolin-4-amine
CCN(CC)c1ccc2c(c1)OC1=C(C=O)CCC1=C2	6-(diethylamino)-1,2-dihydrocyclopenta[b]chromene-3-carbaldehyde
CN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cccn1-c1cccc(C(F)(F)F)c1	(4S,5S)-1-methyl-4-pyridin-2-yl-5-[1-[3-(trifluoromethyl)phenyl]pyrrol-2-yl]imidazolidine-2-thione
FP12=NP(F)(=NP3(=N1)OCP(=S)(C[c-]1cccc1)CO3)OCP(=S)(C[c-]1[cH-][cH-][cH-][cH-]1)CO2.[Fe].[Fe].c1cc[cH-]c1.c1cc[cH-]c1	cyclopenta-1,3-diene;5-(cyclopenta-2,4-dien-1-ylmethyl)-4'-(cyclopentylmethyl)-1',7'-difluoro-4',5-bis(sulfanylidene)spiro[1,3-dioxa-2λ5,5λ5-diphosphacyclohexane-2,9'-2,6-dioxa-8,10,11-triaza-1λ5,4λ5,7λ5,9λ5-tetraphosphabicyclo[5.3.1]undeca-1(11),7,9-triene];iron
CC(C)(C)n1cc(C(=O)c2ccc3ccccc3c2O)cn1	(1-tert-butylpyrazol-4-yl)-(1-hydroxynaphthalen-2-yl)methanone
Cc1cc(C)c(C(=O)N2CCN(c3ncc(F)cc3C#N)CC2)cc1CN1CCN(c2ccccc2C#N)CC1	2-[4-[5-[[4-(2-cyanophenyl)piperazin-1-yl]methyl]-2,4-dimethylbenzoyl]piperazin-1-yl]-5-fluoropyridine-3-carbonitrile
CC(=O)O[C@]12CC=C(C)[C@H](O)C[C@]13CC[C@H]2[C@@](C)(/C=C/C=C(\C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC3=O	[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2E,4E)-5-[(1R,3R,7S,8S,9R)-7-acetyloxy-3-hydroxy-4,9-dimethyl-11-oxo-10-oxatricyclo[6.3.2.01,7]tridec-4-en-9-yl]-2-methylpenta-2,4-dienoate
CC(C)CC(=O)Nc1cc(NC(=O)CC(C)C)cc(NC(=O)CC(C)C)c1	N-[3,5-bis(3-methylbutanoylamino)phenyl]-3-methylbutanamide
CC.COc1ccc(OC(C)C)cc1C(C)C	ethane;1-methoxy-2-propan-2-yl-4-propan-2-yloxybenzene
CCOC(=O)C1CSCCN1CC(=O)Nc1ccc2c(c1)OCCCO2	ethyl 4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]thiomorpholine-3-carboxylate
CCC(CC(=O)N1CCNCC1)c1ccc(C)cc1C	3-(2,4-dimethylphenyl)-1-piperazin-1-ylpentan-1-one
CN1C(=O)C[C@H](c2ccc(O)cc2)[C@@H]1[C@@H](O)c1ccc(-c2ccccc2)s1	(4R,5R)-4-(4-hydroxyphenyl)-5-[(R)-hydroxy-(5-phenylthiophen-2-yl)methyl]-1-methylpyrrolidin-2-one
COc1cc2c(cc1Nc1cc(Nc3ccccc3S(=O)(=O)C(C)C)c(Cl)cn1)C(=O)N(C1CN(C(=O)CN(C)C)C1)C2	6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)pyridin-2-yl]amino]-2-[1-[2-(dimethylamino)acetyl]azetidin-3-yl]-5-methoxy-3H-isoindol-1-one
O=C(Nc1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1)c1ccc(-n2cccn2)cc1	N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-4-pyrazol-1-ylbenzamide
COc1ccc(Oc2ccc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)cc2)cc1	1-tert-butyl-4-[4-(4-methoxyphenoxy)phenyl]sulfonylbenzene
O=C(NNc1ccc(F)cc1)c1cc2c(s1)-c1ccccc1CC2	N'-(4-fluorophenyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carbohydrazide
CN(C=O)Cc1ccc(N)c(C(=O)O)c1.CN(Cc1ccc(N)c(C(=O)O)c1)C(=O)OC(C)(C)C	2-amino-5-[[formyl(methyl)amino]methyl]benzoic acid;2-amino-5-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]benzoic acid
CCNC(=NCCc1cc(OC)ccc1OC)NC(C)c1ccccc1.I	2-[2-(2,5-dimethoxyphenyl)ethyl]-1-ethyl-3-(1-phenylethyl)guanidine;hydroiodide
CN1CCN(C2C[C@@H](c3ccccc3)c3ccc(Cl)cc32)CC1(C)C	4-[(3S)-6-chloro-3-phenyl-2,3-dihydro-1H-inden-1-yl]-1,2,2-trimethylpiperazine
COc1ccccc1C1(C(=O)N2CC(C(=O)O)C(c3ccccc3)C2)CC1	1-[1-(2-methoxyphenyl)cyclopropanecarbonyl]-4-phenylpyrrolidine-3-carboxylic acid
C[C@@H](c1cnc(-c2cc(Oc3c(F)cc4[nH]ccc4c3S(C)(=O)=O)ccc2F)[nH]1)c1cccc(CC(=O)O)c1F	2-[2-fluoro-3-[(1R)-1-[2-[2-fluoro-5-[(6-fluoro-4-methylsulfonyl-1H-indol-5-yl)oxy]phenyl]-1H-imidazol-5-yl]ethyl]phenyl]acetic acid
CC(C)(C)OC(=O)c1nc(Cc2cccc3ccccc23)[nH]c(=O)c1OCc1ccccc1.CC(C)N(CCO)C(=O)c1nc(Cc2cccc3ccccc23)[nH]c(=O)c1OCc1ccccc1.CC(C)N(CCO[Si](C)(C)C(C)(C)C)C(=O)c1nc(Cc2cccc3ccccc23)[nH]c(=O)c1OCc1ccccc1.CC(C)N1CCn2c(Cc3cccc4ccccc34)nc(=O)c(O)c2C1=O.CC(C)N1CCn2c(Cc3cccc4ccccc34)nc(=O)c(OCc3ccccc3)c2C1=O.CC(C)NCCO[Si](C)(C)C(C)(C)C.COC(=O)/C(OCc1ccccc1)=C(\O)C(=O)OC(C)(C)C.Cl.N#CCc1cccc2ccccc12.N=C(N)Cc1cccc2ccccc12.O=C(O)c1nc(Cc2cccc3ccccc23)[nH]c(=O)c1OCc1ccccc1	N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-2-(naphthalen-1-ylmethyl)-6-oxo-5-phenylmethoxy-N-propan-2-yl-1H-pyrimidine-4-carboxamide;N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]propan-2-amine;4-O-tert-butyl 1-O-methyl (E)-3-hydroxy-2-phenylmethoxybut-2-enedioate;tert-butyl 2-(naphthalen-1-ylmethyl)-6-oxo-5-phenylmethoxy-1H-pyrimidine-4-carboxylate;N-(2-hydroxyethyl)-2-(naphthalen-1-ylmethyl)-6-oxo-5-phenylmethoxy-N-propan-2-yl-1H-pyrimidine-4-carboxamide;9-hydroxy-6-(naphthalen-1-ylmethyl)-2-propan-2-yl-3,4-dihydropyrazino[1,2-c]pyrimidine-1,8-dione;2-naphthalen-1-ylacetonitrile;2-naphthalen-1-ylethanimidamide;2-(naphthalen-1-ylmethyl)-6-oxo-5-phenylmethoxy-1H-pyrimidine-4-carboxylic acid;6-(naphthalen-1-ylmethyl)-9-phenylmethoxy-2-propan-2-yl-3,4-dihydropyrazino[1,2-c]pyrimidine-1,8-dione;hydrochloride
Cc1ccc2ncc(C(=O)OCc3ccccc3)cc2c1	benzyl 6-methylquinoline-3-carboxylate
CC(=O)OC12COC1CC(O)[C@@]1(C)C(=O)[C@H](C)C3=C(C)C(O)CC(O)([C@@H](C)C21)C3(C)C	[(2S,10S,12R)-1,9,15-trihydroxy-2,10,12,14,17,17-hexamethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-4-yl] acetate
C[Si](C)(C[NH3+])CCCC(CCC[Si](C)(C)C[CH-][NH3+])(CCC[Si](C)(C)CNCl)c1cc(C(CCC[Si](C)(C)C[CH-][NH3+])(CCC[Si](C)(C)CNCl)CCC[Si](C)(C)CNCl)cc(C(CCC[Si](C)(C)CNCl)(CCC[Si](C)(C)CNCl)CCC[Si](C)(C)CNCl)c1	2-[[4-[3-[1-[2-azaniumylethyl(dimethyl)silyl]-4-[3-[azaniumylmethyl(dimethyl)silyl]propyl]-7-[(chloroamino)methyl-dimethylsilyl]heptan-4-yl]-5-[1,7-bis[(chloroamino)methyl-dimethylsilyl]-4-[3-[(chloroamino)methyl-dimethylsilyl]propyl]heptan-4-yl]phenyl]-7-[(chloroamino)methyl-dimethylsilyl]-4-[3-[(chloroamino)methyl-dimethylsilyl]propyl]heptyl]-dimethylsilyl]ethylazanium
O=C(CCNC(=O)c1ccccc1F)NCC1(c2ccccc2)CCOCC1	2-fluoro-N-[3-oxo-3-[(4-phenyloxan-4-yl)methylamino]propyl]benzamide
CC(=O)NCc1ccccc1CC(C)(C)C.[HH]	N-[[2-(2,2-dimethylpropyl)phenyl]methyl]acetamide;molecular hydrogen
CS(=O)(=O)CCC(=O)NCC(=O)N1CCCCC1	3-methylsulfonyl-N-(2-oxo-2-piperidin-1-ylethyl)propanamide
CSC1CCC(NCC(O)CN(C)C)C1	1-(dimethylamino)-3-[(3-methylsulfanylcyclopentyl)amino]propan-2-ol
CCc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1N	N-(3-amino-4-ethylphenyl)-5-chloro-2-hydroxybenzamide
COc1ccc(F)cc1C(C)(C)CC(O)(Cn1cc(C(F)(F)F)cc(Cl)c1=O)C(F)(F)F	3-chloro-1-[4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-5-(trifluoromethyl)pyridin-2-one
CCOc1ccccc1/C=C/C(=O)NC(C)c1nnc2ccccn12	(E)-3-(2-ethoxyphenyl)-N-[1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]prop-2-enamide
Cc1ccccc1NC1(CN)CC(C)N(C2CC2)C1	3-(aminomethyl)-1-cyclopropyl-5-methyl-N-(2-methylphenyl)pyrrolidin-3-amine
CNC(C)C(c1nc(-c2cscn2)no1)C(C)C	N,4-dimethyl-3-[3-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine
CN1CC(n2c(NC#N)nc3cc(/C=C4/c5ccccc5COc5cc(F)ccc54)ccc32)C1	[5-[(Z)-(3-fluoro-6H-benzo[c][1]benzoxepin-11-ylidene)methyl]-1-(1-methylazetidin-3-yl)benzimidazol-2-yl]cyanamide
CCCCCSCCCN	3-pentylsulfanylpropan-1-amine
CCCc1ccc(C(=O)NCCc2ccc(C)o2)c(F)c1	2-fluoro-N-[2-(5-methylfuran-2-yl)ethyl]-4-propylbenzamide
COc1ccc(NC(=O)NCC2CCCC(O)C2)cc1Cl	1-(3-chloro-4-methoxyphenyl)-3-[(3-hydroxycyclohexyl)methyl]urea
CC(C)=CCCC(C)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(O)C(C)(C)C1CC3.CC(C)=CCc1c(O)cc2oc(C)cc(=O)c2c1O	5,7-dihydroxy-2-methyl-6-(3-methylbut-2-enyl)chromen-4-one;4,4,10,13,14-pentamethyl-17-(6-methylhept-5-en-2-yl)-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
CCOc1cc(OC)c(C(=O)C=CC(=O)N2CCC(N3CCN(C)CC3)CC2)cc1C(C)C	1-(4-ethoxy-2-methoxy-5-propan-2-ylphenyl)-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]but-2-ene-1,4-dione
N#Cc1ccccc1-n1cnc2cc(N)ccc21	2-(5-aminobenzimidazol-1-yl)benzonitrile

C[C@H](CCOCc1ccccc1)[C@H](O)CCO

(3R,4R)-4-methyl-6-phenylmethoxyhexane-1,3-diol

COc1cccc(-c2ccn(CCN)n2)c1

2-[3-(3-methoxyphenyl)pyrazol-1-yl]ethanamine

CCCC1CCN(c2ccccc2CNCC)C1

N-[[2-(3-propylpyrrolidin-1-yl)phenyl]methyl]ethanamine

CCc1ccc(CN(C)Cc2ccccc2)cc1

N-[(4-ethylphenyl)methyl]-N-methyl-1-phenylmethanamine

C[N+](C)(C)CCO.C[N+](C)(C)CCO.O=C([O-])C(O)C(O)C(=O)[O-]

2,3-dihydroxybutanedioate;2-hydroxyethyl(trimethyl)azanium

COc1cccc([C@@H]2CN(C(=O)c3ccccc3F)C[C@@H]2C(=O)NCC2CC2)c1

(3R,4R)-N-(cyclopropylmethyl)-1-(2-fluorobenzoyl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide

O=c1[nH]c2cc(Br)c([N+](=O)[O-])cc2[nH]1

5-bromo-6-nitro-1,3-dihydrobenzimidazol-2-one

c1ccc(-c2cc3ccccc3cc2N(c2ccc3ccccc3c2)c2ccc3c4c(cccc24)C2(c4ccccc4Sc4ccccc42)c2ccccc2-3)cc1

N-naphthalen-2-yl-N-(3-phenylnaphthalen-2-yl)spiro[benzo[a]phenalene-7,9'-thioxanthene]-3-amine

CC1(C)OB(c2ccc3c(ccc4c5ccccc5sc34)c2)OC1(C)C

4,4,5,5-tetramethyl-2-naphtho[1,2-b][1]benzothiol-3-yl-1,3,2-dioxaborolane

CC1(C)N=C(N)N=C(N)N1OCCSCCON1C(N)=NC(N)=NC1(C)C

1-[2-[2-[(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)oxy]ethylsulfanyl]ethoxy]-6,6-dimethyl-1,3,5-triazine-2,4-diamine

CC1(C)COC2=CN(C3CC4CC3CN4)CC=C21

6-(2-azabicyclo[2.2.1]heptan-5-yl)-3,3-dimethyl-2,5-dihydrofuro[2,3-c]pyridine

COc1ccc(-c2c(C(N)=O)nc(N3CCC(N)CC3)nc2-c2ccc(C#N)c(F)c2)cc1F

2-(4-aminopiperidin-1-yl)-6-(4-cyano-3-fluorophenyl)-5-(3-fluoro-4-methoxyphenyl)pyrimidine-4-carboxamide

CC.CC(=O)N1CC2(C1)CN(c1ccc(F)cn1)C2

ethane;1-[6-(5-fluoropyridin-2-yl)-2,6-diazaspiro[3.3]heptan-2-yl]ethanone

Cc1nc(CN2CCOC(C(=O)O)C2)oc1C

4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholine-2-carboxylic acid

CC(C)(CC1CC2CCC1CC2)OCCC1CCCCC1.CC(C)OC(C)(C)CC1CCCCC1

2-[2-(2-cyclohexylethoxy)-2-methylpropyl]bicyclo[2.2.2]octane;(2-methyl-2-propan-2-yloxypropyl)cyclohexane

NP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-]

amino-[oxido(phosphonatooxy)phosphoryl]oxyphosphinate

CCc1ccc[c-]1C(C)(C)[c-]1cccc1CC.[Fe+2].[Fe+2].c1cc[cH-]c1.c1cc[cH-]c1

cyclopenta-1,3-diene;1-ethyl-5-[2-(2-ethylcyclopenta-2,4-dien-1-yl)propan-2-yl]cyclopenta-1,3-diene;iron(2+)

COC1CCN(Cc2ccc(Cl)nc2Cl)C(CN)C1

[1-[(2,6-dichloropyridin-3-yl)methyl]-4-methoxypiperidin-2-yl]methanamine

Cc1cc2occ(CC(=O)Nc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)c2cc1C

2-(5,6-dimethyl-1-benzofuran-3-yl)-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]acetamide

CCCN(Cc1ccc(Br)cn1)C1CNC1

N-[(5-bromopyridin-2-yl)methyl]-N-propylazetidin-3-amine

Cc1ncc(CNc2ccc(Sc3ncn[nH]3)cc2)s1

N-[(2-methyl-1,3-thiazol-5-yl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline

CCN(c1ccnc(C(=O)NC)c1)C1CCC(N)CC1

4-[(4-aminocyclohexyl)-ethylamino]-N-methylpyridine-2-carboxamide

C=CCc1ccc(OCCn2cc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)c3ccccc32)c(OC)c1

1-(4-fluorophenyl)-5-[[1-[2-(2-methoxy-4-prop-2-enylphenoxy)ethyl]indol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione

CC(C)CC(=O)CC1CCc2cc(-c3noc(C(F)F)n3)ccc21

1-[5-[5-(difluoromethyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]-4-methylpentan-2-one

O=C(CI)NNC(=O)NC(=O)c1ccccc1

N-[[(2-iodoacetyl)amino]carbamoyl]benzamide

O=C(Nc1cc(Cl)c(-c2ccnc(F)c2)cc1F)N1[C@H]2CC[C@@H]1c1n[nH]c(=O)cc1C2

(1R,9S)-N-[5-chloro-2-fluoro-4-(2-fluoropyridin-4-yl)phenyl]-5-oxo-3,4,12-triazatricyclo[7.2.1.02,7]dodeca-2,6-diene-12-carboxamide

Clc1c[nH]c2nccc(-c3ccc4c(c3)OCO4)c12

4-(1,3-benzodioxol-5-yl)-3-chloro-1H-pyrrolo[2,3-b]pyridine

C=C/C(C#N)=C\C=C(/CCn1cc[n+](C)c1CO)[C@@H]1C(C(=O)OC)=C(C)N(c2cccc(C(F)(F)F)c2)c2n[nH]c(=O)n21.COC=O

methyl (5R)-5-[(3E,5E)-6-cyano-1-[2-(hydroxymethyl)-3-methylimidazol-3-ium-1-yl]octa-3,5,7-trien-3-yl]-7-methyl-3-oxo-8-[3-(trifluoromethyl)phenyl]-2,5-dihydro-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylate;methyl formate

CN(C(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O)C1CCS(=O)(=O)C1

2-(3-chloro-N-methylsulfonylanilino)-N-(1,1-dioxothiolan-3-yl)-N-methylacetamide

CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)(O)CCC1=C(C)C(=O)C=C(C)C1=O.CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)(O)CCC1=CC(=O)C(C)=C(C)C1=O.CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)(O)CCC1=CC(=O)C=C(C)C1=O

3-[(6E,10E)-3-hydroxy-3,7,11,15-tetramethylhexadeca-6,10,14-trienyl]-2,5-dimethylcyclohexa-2,5-diene-1,4-dione;5-[(6E,10E)-3-hydroxy-3,7,11,15-tetramethylhexadeca-6,10,14-trienyl]-2,3-dimethylcyclohexa-2,5-diene-1,4-dione;2-[(6E,10E)-3-hydroxy-3,7,11,15-tetramethylhexadeca-6,10,14-trienyl]-6-methylcyclohexa-2,5-diene-1,4-dione

COc1ccc2c(c1)c(C=O)cn2CCCI

1-(3-iodopropyl)-5-methoxyindole-3-carbaldehyde

COc1ccc(I(OC(C)=O)OC(C)=O)c2c1CCC[C@H]2OC(=O)C(C)(C)C

[(1R)-8-(diacetyloxy-λ3-iodanyl)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl] 2,2-dimethylpropanoate

CCC(C)(C)NC(=O)C(c1ccccc1Cl)N(C(=O)Cn1nnc2ccccc21)c1cccc(C(C)=O)c1

2-(3-acetyl-N-[2-(benzotriazol-1-yl)acetyl]anilino)-2-(2-chlorophenyl)-N-(2-methylbutan-2-yl)acetamide

CNc1nc(Nc2cn(Cc3cccc(C)n3)nc2C)ncc1C(F)(F)F

4-N-methyl-2-N-[3-methyl-1-[(6-methylpyridin-2-yl)methyl]pyrazol-4-yl]-5-(trifluoromethyl)pyrimidine-2,4-diamine

COc1ccc(OC)c(C(=O)Nc2ccc(Br)cc2C(=O)c2ccccc2Cl)c1

N-[4-bromo-2-(2-chlorobenzoyl)phenyl]-2,5-dimethoxybenzamide

O=C(O)CC1(NC(=O)c2c[nH]ccc2=O)CCC1

2-[1-[(4-oxo-1H-pyridine-3-carbonyl)amino]cyclobutyl]acetic acid

CC#CCCNC(CN)c1ccc(C)c(Cl)c1

1-(3-chloro-4-methylphenyl)-N-pent-3-ynylethane-1,2-diamine

CCc1ccc(Cc2ccc(COC(C)=O)cc2OC2O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]2O)cc1

[(2R,3S,4S,5R)-6-[5-(acetyloxymethyl)-2-[(4-ethylphenyl)methyl]phenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl acetate

O=C(c1cccs1)N1CCCN(c2nc3c(cnn3-c3ccccc3)c(=O)[nH]2)CC1

1-phenyl-6-[4-(thiophene-2-carbonyl)-1,4-diazepan-1-yl]-5H-pyrazolo[3,4-d]pyrimidin-4-one

C[C@@H](CCCC(N)=O)C[C@H](OC(=O)[C@H](C)CC/C=C/I)C(C)(C)C

[(3S,5S)-9-amino-2,2,5-trimethyl-9-oxononan-3-yl] (E,2R)-6-iodo-2-methylhex-5-enoate

NCCc1ccc(S(=O)(=O)N2CCS(=O)CC2)cc1

2-[4-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]phenyl]ethanamine

CCNC(C1=CCCCC1)C1CCC(CC)C1

N-[cyclohexen-1-yl-(3-ethylcyclopentyl)methyl]ethanamine

O=C(O)C[C@H](NC(=O)[C@@H]1CCCN(CCCc2ccc3c(n2)NCCC3)C1)c1cccc([C@@H]2CCOC2)c1

(3S)-3-[3-[(3S)-oxolan-3-yl]phenyl]-3-[[(3R)-1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidine-3-carbonyl]amino]propanoic acid

Cc1cnn(-c2ccccc2C2(C)CCCN2)n1

4-methyl-2-[2-(2-methylpyrrolidin-2-yl)phenyl]triazole

c1ccc(-c2cc(-c3ccc(-n4c5cc6ccsc6cc5c5c6ccccc6c6ccccc6c54)cc3)nc(-c3ccccc3)n2)cc1

24-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-18-thia-24-azahexacyclo[12.10.0.02,7.08,13.015,23.017,21]tetracosa-1(14),2,4,6,8,10,12,15(23),16,19,21-undecaene

Cc1cc(Cn2cc3c(NC(=O)C(C)C)nccc3n2)cnc1OCc1ccc(F)cc1

N-[2-[[6-[(4-fluorophenyl)methoxy]-5-methylpyridin-3-yl]methyl]pyrazolo[4,3-c]pyridin-4-yl]-2-methylpropanamide

NCC(CO)c1c[nH]c2ncccc12

3-amino-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)propan-1-ol

CCNc1cc(C(=O)Nc2nc(C(C)C)cs2)c(Cl)cn1

5-chloro-2-(ethylamino)-N-(4-propan-2-yl-1,3-thiazol-2-yl)pyridine-4-carboxamide

C=CCOc1cccc([C@@H]2/C(=C(\O)c3ccc4c(c3)C[C@H](C)O4)C(=O)C(=O)N2c2nc(C)c(C(=O)OC)s2)c1

methyl 2-[(4E,5R)-4-[hydroxy-[(2S)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]methylidene]-2,3-dioxo-5-(3-prop-2-enoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

CCOc1cn(-c2ccc(F)cc2C(C)C)nc1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1

N-[5-(6,7-dimethoxyquinolin-4-yl)oxypyridin-2-yl]-4-ethoxy-1-(4-fluoro-2-propan-2-ylphenyl)pyrazole-3-carboxamide

CCc1nn2c(c1-c1c(Cl)ccc3c(CCCOc4cccc5cc(F)ccc45)c(C(=O)O)n(CCN4CCNCC4)c13)COCC2.Cl

6-chloro-7-(2-ethyl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazin-3-yl)-3-[3-(6-fluoronaphthalen-1-yl)oxypropyl]-1-(2-piperazin-1-ylethyl)indole-2-carboxylic acid;hydrochloride

Nc1ncc2c(n1)CN(S(=O)(=O)c1ccc(C(F)(F)F)cc1)CC2

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

CC(=O)Nc1cc(-c2[nH]c3cc(OC4COC4)cnc3c2-c2cccc(C(F)F)n2)ccn1

N-[4-[3-[6-(difluoromethyl)pyridin-2-yl]-6-(oxetan-3-yloxy)-1H-pyrrolo[3,2-b]pyridin-2-yl]pyridin-2-yl]acetamide

CC[C@H](C)NC(=O)[C@H](CC)N(Cc1ccc(Cl)cc1Cl)C(=O)CN(c1cc(C)ccc1OC)S(C)(=O)=O

(2S)-N-[(2S)-butan-2-yl]-2-[(2,4-dichlorophenyl)methyl-[2-(2-methoxy-5-methyl-N-methylsulfonylanilino)acetyl]amino]butanamide

Cc1cc(-c2ccc(C(=O)CS(=O)(=O)c3cccc(N)n3)c(N3C[C@@H](C)CC3(C)C)n2)cnc1OCCOC(C)C.[HH].[HH]

2-(6-aminopyridin-2-yl)sulfonyl-1-[6-[5-methyl-6-(2-propan-2-yloxyethoxy)pyridin-3-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridin-3-yl]ethanone;molecular hydrogen

C1CCNCC1.Cn1cc(-c2cc(Sc3cccc4cn[nH]c34)c3c(C#N)cnn3c2)cn1

4-(1H-indazol-7-ylsulfanyl)-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;piperidine

CC(=O)NC(C(=O)Oc1ccc(N(C)C(=O)c2ccc(C)cc2)cc1)C1CCCC1

[4-[methyl-(4-methylbenzoyl)amino]phenyl] 2-acetamido-2-cyclopentylacetate

Cc1cccc(C)c1NC(=O)C[NH+](C)CC(=O)Nc1ccc2c(c1)OC(F)(F)O2

[2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl]-[2-(2,6-dimethylanilino)-2-oxoethyl]-methylazanium

COC(=O)C(Nc1cncc(NN)n1)C(C)C

methyl 2-[(6-hydrazinylpyrazin-2-yl)amino]-3-methylbutanoate

C=CCNc1nc(N2CCN(c3ccccn3)CC2)nc2ccccc12

N-prop-2-enyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinazolin-4-amine

CCN(CC)c1ccc2c(c1)OC1=C(C=O)CCC1=C2

6-(diethylamino)-1,2-dihydrocyclopenta[b]chromene-3-carbaldehyde

CN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cccn1-c1cccc(C(F)(F)F)c1

(4S,5S)-1-methyl-4-pyridin-2-yl-5-[1-[3-(trifluoromethyl)phenyl]pyrrol-2-yl]imidazolidine-2-thione

FP12=NP(F)(=NP3(=N1)OCP(=S)(C[c-]1cccc1)CO3)OCP(=S)(C[c-]1[cH-][cH-][cH-][cH-]1)CO2.[Fe].[Fe].c1cc[cH-]c1.c1cc[cH-]c1

cyclopenta-1,3-diene;5-(cyclopenta-2,4-dien-1-ylmethyl)-4'-(cyclopentylmethyl)-1',7'-difluoro-4',5-bis(sulfanylidene)spiro[1,3-dioxa-2λ5,5λ5-diphosphacyclohexane-2,9'-2,6-dioxa-8,10,11-triaza-1λ5,4λ5,7λ5,9λ5-tetraphosphabicyclo[5.3.1]undeca-1(11),7,9-triene];iron

CC(C)(C)n1cc(C(=O)c2ccc3ccccc3c2O)cn1

(1-tert-butylpyrazol-4-yl)-(1-hydroxynaphthalen-2-yl)methanone

Cc1cc(C)c(C(=O)N2CCN(c3ncc(F)cc3C#N)CC2)cc1CN1CCN(c2ccccc2C#N)CC1

2-[4-[5-[[4-(2-cyanophenyl)piperazin-1-yl]methyl]-2,4-dimethylbenzoyl]piperazin-1-yl]-5-fluoropyridine-3-carbonitrile

CC(=O)O[C@]12CC=C(C)[C@H](O)C[C@]13CC[C@H]2[C@@](C)(/C=C/C=C(\C)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC3=O

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2E,4E)-5-[(1R,3R,7S,8S,9R)-7-acetyloxy-3-hydroxy-4,9-dimethyl-11-oxo-10-oxatricyclo[6.3.2.01,7]tridec-4-en-9-yl]-2-methylpenta-2,4-dienoate

CC(C)CC(=O)Nc1cc(NC(=O)CC(C)C)cc(NC(=O)CC(C)C)c1

N-[3,5-bis(3-methylbutanoylamino)phenyl]-3-methylbutanamide

CC.COc1ccc(OC(C)C)cc1C(C)C

ethane;1-methoxy-2-propan-2-yl-4-propan-2-yloxybenzene

CCOC(=O)C1CSCCN1CC(=O)Nc1ccc2c(c1)OCCCO2

ethyl 4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl]thiomorpholine-3-carboxylate

CCC(CC(=O)N1CCNCC1)c1ccc(C)cc1C

3-(2,4-dimethylphenyl)-1-piperazin-1-ylpentan-1-one

CN1C(=O)C[C@H](c2ccc(O)cc2)[C@@H]1[C@@H](O)c1ccc(-c2ccccc2)s1

(4R,5R)-4-(4-hydroxyphenyl)-5-[(R)-hydroxy-(5-phenylthiophen-2-yl)methyl]-1-methylpyrrolidin-2-one

COc1cc2c(cc1Nc1cc(Nc3ccccc3S(=O)(=O)C(C)C)c(Cl)cn1)C(=O)N(C1CN(C(=O)CN(C)C)C1)C2

6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)pyridin-2-yl]amino]-2-[1-[2-(dimethylamino)acetyl]azetidin-3-yl]-5-methoxy-3H-isoindol-1-one

O=C(Nc1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1)c1ccc(-n2cccn2)cc1

N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-4-pyrazol-1-ylbenzamide

COc1ccc(Oc2ccc(S(=O)(=O)c3ccc(C(C)(C)C)cc3)cc2)cc1

1-tert-butyl-4-[4-(4-methoxyphenoxy)phenyl]sulfonylbenzene

O=C(NNc1ccc(F)cc1)c1cc2c(s1)-c1ccccc1CC2

N'-(4-fluorophenyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carbohydrazide

CN(C=O)Cc1ccc(N)c(C(=O)O)c1.CN(Cc1ccc(N)c(C(=O)O)c1)C(=O)OC(C)(C)C

2-amino-5-[[formyl(methyl)amino]methyl]benzoic acid;2-amino-5-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]benzoic acid

CCNC(=NCCc1cc(OC)ccc1OC)NC(C)c1ccccc1.I

2-[2-(2,5-dimethoxyphenyl)ethyl]-1-ethyl-3-(1-phenylethyl)guanidine;hydroiodide

CN1CCN(C2C[C@@H](c3ccccc3)c3ccc(Cl)cc32)CC1(C)C

4-[(3S)-6-chloro-3-phenyl-2,3-dihydro-1H-inden-1-yl]-1,2,2-trimethylpiperazine

COc1ccccc1C1(C(=O)N2CC(C(=O)O)C(c3ccccc3)C2)CC1

1-[1-(2-methoxyphenyl)cyclopropanecarbonyl]-4-phenylpyrrolidine-3-carboxylic acid

C[C@@H](c1cnc(-c2cc(Oc3c(F)cc4[nH]ccc4c3S(C)(=O)=O)ccc2F)[nH]1)c1cccc(CC(=O)O)c1F

2-[2-fluoro-3-[(1R)-1-[2-[2-fluoro-5-[(6-fluoro-4-methylsulfonyl-1H-indol-5-yl)oxy]phenyl]-1H-imidazol-5-yl]ethyl]phenyl]acetic acid

CC(C)(C)OC(=O)c1nc(Cc2cccc3ccccc23)[nH]c(=O)c1OCc1ccccc1.CC(C)N(CCO)C(=O)c1nc(Cc2cccc3ccccc23)[nH]c(=O)c1OCc1ccccc1.CC(C)N(CCO[Si](C)(C)C(C)(C)C)C(=O)c1nc(Cc2cccc3ccccc23)[nH]c(=O)c1OCc1ccccc1.CC(C)N1CCn2c(Cc3cccc4ccccc34)nc(=O)c(O)c2C1=O.CC(C)N1CCn2c(Cc3cccc4ccccc34)nc(=O)c(OCc3ccccc3)c2C1=O.CC(C)NCCO[Si](C)(C)C(C)(C)C.COC(=O)/C(OCc1ccccc1)=C(\O)C(=O)OC(C)(C)C.Cl.N#CCc1cccc2ccccc12.N=C(N)Cc1cccc2ccccc12.O=C(O)c1nc(Cc2cccc3ccccc23)[nH]c(=O)c1OCc1ccccc1

N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-2-(naphthalen-1-ylmethyl)-6-oxo-5-phenylmethoxy-N-propan-2-yl-1H-pyrimidine-4-carboxamide;N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]propan-2-amine;4-O-tert-butyl 1-O-methyl (E)-3-hydroxy-2-phenylmethoxybut-2-enedioate;tert-butyl 2-(naphthalen-1-ylmethyl)-6-oxo-5-phenylmethoxy-1H-pyrimidine-4-carboxylate;N-(2-hydroxyethyl)-2-(naphthalen-1-ylmethyl)-6-oxo-5-phenylmethoxy-N-propan-2-yl-1H-pyrimidine-4-carboxamide;9-hydroxy-6-(naphthalen-1-ylmethyl)-2-propan-2-yl-3,4-dihydropyrazino[1,2-c]pyrimidine-1,8-dione;2-naphthalen-1-ylacetonitrile;2-naphthalen-1-ylethanimidamide;2-(naphthalen-1-ylmethyl)-6-oxo-5-phenylmethoxy-1H-pyrimidine-4-carboxylic acid;6-(naphthalen-1-ylmethyl)-9-phenylmethoxy-2-propan-2-yl-3,4-dihydropyrazino[1,2-c]pyrimidine-1,8-dione;hydrochloride

Cc1ccc2ncc(C(=O)OCc3ccccc3)cc2c1

benzyl 6-methylquinoline-3-carboxylate

CC(=O)OC12COC1CC(O)[C@@]1(C)C(=O)[C@H](C)C3=C(C)C(O)CC(O)([C@@H](C)C21)C3(C)C

[(2S,10S,12R)-1,9,15-trihydroxy-2,10,12,14,17,17-hexamethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-4-yl] acetate

C[Si](C)(C[NH3+])CCCC(CCC[Si](C)(C)C[CH-][NH3+])(CCC[Si](C)(C)CNCl)c1cc(C(CCC[Si](C)(C)C[CH-][NH3+])(CCC[Si](C)(C)CNCl)CCC[Si](C)(C)CNCl)cc(C(CCC[Si](C)(C)CNCl)(CCC[Si](C)(C)CNCl)CCC[Si](C)(C)CNCl)c1

2-[[4-[3-[1-[2-azaniumylethyl(dimethyl)silyl]-4-[3-[azaniumylmethyl(dimethyl)silyl]propyl]-7-[(chloroamino)methyl-dimethylsilyl]heptan-4-yl]-5-[1,7-bis[(chloroamino)methyl-dimethylsilyl]-4-[3-[(chloroamino)methyl-dimethylsilyl]propyl]heptan-4-yl]phenyl]-7-[(chloroamino)methyl-dimethylsilyl]-4-[3-[(chloroamino)methyl-dimethylsilyl]propyl]heptyl]-dimethylsilyl]ethylazanium

O=C(CCNC(=O)c1ccccc1F)NCC1(c2ccccc2)CCOCC1

2-fluoro-N-[3-oxo-3-[(4-phenyloxan-4-yl)methylamino]propyl]benzamide

CC(=O)NCc1ccccc1CC(C)(C)C.[HH]

N-[[2-(2,2-dimethylpropyl)phenyl]methyl]acetamide;molecular hydrogen

CS(=O)(=O)CCC(=O)NCC(=O)N1CCCCC1

3-methylsulfonyl-N-(2-oxo-2-piperidin-1-ylethyl)propanamide

CSC1CCC(NCC(O)CN(C)C)C1

1-(dimethylamino)-3-[(3-methylsulfanylcyclopentyl)amino]propan-2-ol

CCc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1N

N-(3-amino-4-ethylphenyl)-5-chloro-2-hydroxybenzamide

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1cc(C(F)(F)F)cc(Cl)c1=O)C(F)(F)F

3-chloro-1-[4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-5-(trifluoromethyl)pyridin-2-one

CCOc1ccccc1/C=C/C(=O)NC(C)c1nnc2ccccn12

(E)-3-(2-ethoxyphenyl)-N-[1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]prop-2-enamide

Cc1ccccc1NC1(CN)CC(C)N(C2CC2)C1

3-(aminomethyl)-1-cyclopropyl-5-methyl-N-(2-methylphenyl)pyrrolidin-3-amine

CNC(C)C(c1nc(-c2cscn2)no1)C(C)C

N,4-dimethyl-3-[3-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine

CN1CC(n2c(NC#N)nc3cc(/C=C4/c5ccccc5COc5cc(F)ccc54)ccc32)C1

[5-[(Z)-(3-fluoro-6H-benzo[c][1]benzoxepin-11-ylidene)methyl]-1-(1-methylazetidin-3-yl)benzimidazol-2-yl]cyanamide

CCCCCSCCCN

3-pentylsulfanylpropan-1-amine

CCCc1ccc(C(=O)NCCc2ccc(C)o2)c(F)c1

2-fluoro-N-[2-(5-methylfuran-2-yl)ethyl]-4-propylbenzamide

COc1ccc(NC(=O)NCC2CCCC(O)C2)cc1Cl

1-(3-chloro-4-methoxyphenyl)-3-[(3-hydroxycyclohexyl)methyl]urea

CC(C)=CCCC(C)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(O)C(C)(C)C1CC3.CC(C)=CCc1c(O)cc2oc(C)cc(=O)c2c1O

5,7-dihydroxy-2-methyl-6-(3-methylbut-2-enyl)chromen-4-one;4,4,10,13,14-pentamethyl-17-(6-methylhept-5-en-2-yl)-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

CCOc1cc(OC)c(C(=O)C=CC(=O)N2CCC(N3CCN(C)CC3)CC2)cc1C(C)C

1-(4-ethoxy-2-methoxy-5-propan-2-ylphenyl)-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]but-2-ene-1,4-dione

N#Cc1ccccc1-n1cnc2cc(N)ccc21

2-(5-aminobenzimidazol-1-yl)benzonitrile