CAS RN: 6045-46-1
CAS Name: 4-amino-2,2,5,5-tetramethyl-1-oxido-3-pyrrolidinecarboxylic acid
OPENEYE Name: 4-amino-2,2,5,5-tetramethyl-1-oxido-pyrrolidine-3-carboxylic acid
IUPAC Name: 4-amino-2,2,5,5-tetramethyl-1-oxidopyrrolidine-3-carboxylic acid
SYSTEMATIC NAME: 4-azanyl-2,2,5,5-tetramethyl-1-oxidanidyl-pyrrolidine-3-carboxylic acid
MOLECULAR FORMULA: C9H17N2O3-
MOLECULAR WEIGHT: 201.24288
SMILES: CC1(C(C(C(N1[O-])(C)C)N)C(=O)O)C
Structure:
CAS RN: 6362-36-3
CAS Name: N1,N2-bis[4-(4-propan-2-ylphenyl)-2-thiazolyl]benzene-1,2-dicarboxamide
OPENEYE Name: N1,N2-bis[4-(4-isopropylphenyl)thiazol-2-yl]phthalamide
IUPAC Name: 1-N,2-N-bis[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]benzene-1,2-dicarboxamide
SYSTEMATIC NAME: N1,N2-bis[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]benzene-1,2-dicarboxamide
MOLECULAR FORMULA: C32H30N4O2S2
MOLECULAR WEIGHT: 566.7362
SMILES: CC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CC=C3C(=O)NC4=NC(=CS4)C5=CC=C(C=C5)C(C)C
Structure:
CAS RN: 5331-16-8
CAS Name: N-[1-(2,6-dimethylanilino)-1-oxo-3-phenylmethoxypropan-2-yl]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[1-(benzyloxymethyl)-2-(2,6-dimethylanilino)-2-oxo-ethyl]carbamate
IUPAC Name: tert-butyl N-[1-(2,6-dimethylanilino)-1-oxo-3-phenylmethoxypropan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[1-[(2,6-dimethylphenyl)amino]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]carbamate
MOLECULAR FORMULA: C23H30N2O4
MOLECULAR WEIGHT: 398.4953
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C(COCC2=CC=CC=C2)NC(=O)OC(C)(C)C
Structure:
CAS RN: 6085-87-6
CAS Name: acetic acid [1-[3-[4-[4-(hydroxymethyl)phenyl]-6-[[(1-methyl-5-tetrazolyl)thio]methyl]-5-phenyl-1,3-dioxan-2-yl]anilino]-1-oxopropan-2-yl] ester
OPENEYE Name: [2-[3-[4-[4-(hydroxymethyl)phenyl]-6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-5-phenyl-1,3-dioxan-2-yl]anilino]-1-methyl-2-oxo-ethyl] acetate
IUPAC Name: [1-[3-[4-[4-(hydroxymethyl)phenyl]-6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-5-phenyl-1,3-dioxan-2-yl]anilino]-1-oxopropan-2-yl] acetate
SYSTEMATIC NAME: [1-[[3-[4-[4-(hydroxymethyl)phenyl]-6-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-5-phenyl-1,3-dioxan-2-yl]phenyl]amino]-1-oxidanylidene-propan-2-yl] ethanoate
MOLECULAR FORMULA: C31H33N5O6S
MOLECULAR WEIGHT: 603.68862
SMILES: CC(C(=O)NC1=CC=CC(=C1)C2OC(C(C(O2)C3=CC=C(C=C3)CO)C4=CC=CC=C4)CSC5=NN=NN5C)OC(=O)C
Structure:
CAS RN: 6036-47-1
CAS Name: 2-(2,4-dichlorophenyl)-N-phenyl-3-thiazolidinecarboxamide
OPENEYE Name: 2-(2,4-dichlorophenyl)-N-phenyl-thiazolidine-3-carboxamide
IUPAC Name: 2-(2,4-dichlorophenyl)-N-phenyl-1,3-thiazolidine-3-carboxamide
SYSTEMATIC NAME: 2-(2,4-dichlorophenyl)-N-phenyl-1,3-thiazolidine-3-carboxamide
MOLECULAR FORMULA: C16H14Cl2N2OS
MOLECULAR WEIGHT: 353.26616
SMILES: C1CSC(N1C(=O)NC2=CC=CC=C2)C3=C(C=C(C=C3)Cl)Cl
Structure:
CAS RN: 6031-56-7
CAS Name: 2-[[(4-tert-butylphenyl)methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]methyl]-N-(2-fluorophenyl)-4-thiazolecarboxamide
OPENEYE Name: 2-[[(4-tert-butylphenyl)methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]methyl]-N-(2-fluorophenyl)thiazole-4-carboxamide
IUPAC Name: 2-[[(4-tert-butylphenyl)methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide
SYSTEMATIC NAME: 2-[[(4-tert-butylphenyl)methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]methyl]-N-(2-fluorophenyl)-1,3-thiazole-4-carboxamide
MOLECULAR FORMULA: C30H29F4N3OS
MOLECULAR WEIGHT: 555.629373
SMILES: CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC(=CC=C2)C(F)(F)F)CC3=NC(=CS3)C(=O)NC4=CC=CC=C4F
Structure:
CAS RN: 5869-80-7
CAS Name: 1-(2-methoxy-5-methylphenyl)sulfonyl-N,N-bis(phenylmethyl)-3-piperidinecarboxamide
OPENEYE Name: N,N-dibenzyl-1-(2-methoxy-5-methyl-phenyl)sulfonyl-piperidine-3-carboxamide
IUPAC Name: N,N-dibenzyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-3-carboxamide
SYSTEMATIC NAME: 1-(2-methoxy-5-methyl-phenyl)sulfonyl-N,N-bis(phenylmethyl)piperidine-3-carboxamide
MOLECULAR FORMULA: C28H32N2O4S
MOLECULAR WEIGHT: 492.62968
SMILES: CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCC(C2)C(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4
Structure:
CAS RN: 6313-08-2
CAS Name: 1-cyclopentyl-1-(2-furanylmethyl)-3-(3-methoxy-4-methylphenyl)thiourea
OPENEYE Name: 1-cyclopentyl-1-(2-furylmethyl)-3-(3-methoxy-4-methyl-phenyl)thiourea
IUPAC Name: 1-cyclopentyl-1-(furan-2-ylmethyl)-3-(3-methoxy-4-methylphenyl)thiourea
SYSTEMATIC NAME: 1-cyclopentyl-1-(furan-2-ylmethyl)-3-(3-methoxy-4-methyl-phenyl)thiourea
MOLECULAR FORMULA: C19H24N2O2S
MOLECULAR WEIGHT: 344.47106
SMILES: CC1=C(C=C(C=C1)NC(=S)N(CC2=CC=CO2)C3CCCC3)OC
Structure:
CAS RN: 6615-77-6
CAS Name: 4-[(4-butoxyphenyl)-hydroxymethylidene]-5-(3-chlorophenyl)-1-[5-[(2-fluorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
OPENEYE Name: 4-[(4-butoxyphenyl)-hydroxy-methylene]-5-(3-chlorophenyl)-1-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
IUPAC Name: 4-[(4-butoxyphenyl)-hydroxymethylidene]-5-(3-chlorophenyl)-1-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
SYSTEMATIC NAME: 4-[(4-butoxyphenyl)-oxidanyl-methylidene]-5-(3-chlorophenyl)-1-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-2,3-dione
MOLECULAR FORMULA: C30H25ClFN3O4S2
MOLECULAR WEIGHT: 610.118603
SMILES: CCCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NN=C(S3)SCC4=CC=CC=C4F)C5=CC(=CC=C5)Cl)O
Structure:
CAS RN: 6615-16-3
CAS Name: 2,6-dimethyl-4-(4-phenylmethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid bis(prop-2-enyl) ester
OPENEYE Name: diallyl 4-(4-benzyloxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
IUPAC Name: bis(prop-2-enyl) 2,6-dimethyl-4-(4-phenylmethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
SYSTEMATIC NAME: bis(prop-2-enyl) 2,6-dimethyl-4-(4-phenylmethoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
MOLECULAR FORMULA: C28H29NO5
MOLECULAR WEIGHT: 459.53356
SMILES: CC1=C(C(C(=C(N1)C)C(=O)OCC=C)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)OCC=C
Structure:
CAS RN: 6612-71-1
CAS Name: 2-(1-azepanyl)-5-[(4-pentoxyphenyl)methylidene]-4-thiazolone
OPENEYE Name: 2-(azepan-1-yl)-5-[(4-pentoxyphenyl)methylene]thiazol-4-one
IUPAC Name: 2-(azepan-1-yl)-5-[(4-pentoxyphenyl)methylidene]-1,3-thiazol-4-one
SYSTEMATIC NAME: 2-(azepan-1-yl)-5-[(4-pentoxyphenyl)methylidene]-1,3-thiazol-4-one
MOLECULAR FORMULA: C21H28N2O2S
MOLECULAR WEIGHT: 372.52422
SMILES: CCCCCOC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCCCCC3
Structure:
CAS RN: 7226-51-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H17BrO2
MOLECULAR WEIGHT: 321.20898
SMILES: C1CC2C3C4C1C(C2Br)OC4C5=CC=CC=C5C3O
Structure:
CAS RN: 7226-50-8
CAS Name: 4,6-bis[(4-methylphenyl)thio]-2-pyrimidinamine
OPENEYE Name: 4,6-bis(p-tolylsulfanyl)pyrimidin-2-amine
IUPAC Name: 4,6-bis[(4-methylphenyl)sulfanyl]pyrimidin-2-amine
SYSTEMATIC NAME: 4,6-bis[(4-methylphenyl)sulfanyl]pyrimidin-2-amine
MOLECULAR FORMULA: C18H17N3S2
MOLECULAR WEIGHT: 339.47768
SMILES: CC1=CC=C(C=C1)SC2=CC(=NC(=N2)N)SC3=CC=C(C=C3)C
Structure:
CAS RN: 5481-74-3
CAS Name: 5-[[2-[[3-(methylthio)-1,2,4-thiadiazol-5-yl]thio]-1-oxoethyl]amino]-1-phenyl-4-imidazolecarboxylic acid ethyl ester
OPENEYE Name: ethyl 5-[[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]acetyl]amino]-1-phenyl-imidazole-4-carboxylate
IUPAC Name: ethyl 5-[[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]acetyl]amino]-1-phenylimidazole-4-carboxylate
SYSTEMATIC NAME: ethyl 5-[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanoylamino]-1-phenyl-imidazole-4-carboxylate
MOLECULAR FORMULA: C17H17N5O3S3
MOLECULAR WEIGHT: 435.54358
SMILES: CCOC(=O)C1=C(N(C=N1)C2=CC=CC=C2)NC(=O)CSC3=NC(=NS3)SC
Structure:
CAS RN: 5481-13-0
CAS Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-cyclohexylamino]-N-(2,4-difluorophenyl)acetamide
OPENEYE Name: 2-[(3-chloro-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]-N-(2,4-difluorophenyl)acetamide
IUPAC Name: 2-[(3-chloro-4-methoxyphenyl)sulfonyl-cyclohexylamino]-N-(2,4-difluorophenyl)acetamide
SYSTEMATIC NAME: N-[2,4-bis(fluoranyl)phenyl]-2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]ethanamide
MOLECULAR FORMULA: C21H23ClF2N2O4S
MOLECULAR WEIGHT: 472.933126
SMILES: COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(C=C(C=C2)F)F)C3CCCCC3)Cl
Structure:
CAS RN: 5065-37-2
CAS Name: 6-ethoxy-1-[3-methoxy-4-(2-methylpropoxy)phenyl]-1,2,3,4-tetrahydroisoquinoline
OPENEYE Name: 6-ethoxy-1-(4-isobutoxy-3-methoxy-phenyl)-1,2,3,4-tetrahydroisoquinoline
IUPAC Name: 6-ethoxy-1-[3-methoxy-4-(2-methylpropoxy)phenyl]-1,2,3,4-tetrahydroisoquinoline
SYSTEMATIC NAME: 6-ethoxy-1-[3-methoxy-4-(2-methylpropoxy)phenyl]-1,2,3,4-tetrahydroisoquinoline
MOLECULAR FORMULA: C22H29NO3
MOLECULAR WEIGHT: 355.47056
SMILES: CCOC1=CC2=C(C=C1)C(NCC2)C3=CC(=C(C=C3)OCC(C)C)OC
Structure:
CAS RN: 5324-76-5
CAS Name: N-[[5-(4-acetylphenyl)-2-furanyl]methylideneamino]-3-hydroxy-2-naphthalenecarboxamide
OPENEYE Name: N-[[5-(4-acetylphenyl)-2-furyl]methyleneamino]-3-hydroxy-naphthalene-2-carboxamide
IUPAC Name: N-[[5-(4-acetylphenyl)furan-2-yl]methylideneamino]-3-hydroxynaphthalene-2-carboxamide
SYSTEMATIC NAME: N-[[5-(4-ethanoylphenyl)furan-2-yl]methylideneamino]-3-oxidanyl-naphthalene-2-carboxamide
MOLECULAR FORMULA: C24H18N2O4
MOLECULAR WEIGHT: 398.41072
SMILES: CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=NNC(=O)C3=CC4=CC=CC=C4C=C3O
Structure:
CAS RN: 5321-70-0
CAS Name: N-tert-butyl-4-[[(4-methylphenyl)thio]methyl]benzamide
OPENEYE Name: N-tert-butyl-4-(p-tolylsulfanylmethyl)benzamide
IUPAC Name: N-tert-butyl-4-[(4-methylphenyl)sulfanylmethyl]benzamide
SYSTEMATIC NAME: N-tert-butyl-4-[(4-methylphenyl)sulfanylmethyl]benzamide
MOLECULAR FORMULA: C19H23NOS
MOLECULAR WEIGHT: 313.45702
SMILES: CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NC(C)(C)C
Structure:
CAS RN: 5654-58-0
CAS Name: 4-[[[oxo-[2-(3-pyridinyl)-4-quinolinyl]methyl]hydrazinylidene]methyl]benzoic acid
OPENEYE Name: 4-[[[2-(3-pyridyl)quinoline-4-carbonyl]hydrazono]methyl]benzoic acid
IUPAC Name: 4-[[(2-pyridin-3-ylquinoline-4-carbonyl)hydrazinylidene]methyl]benzoic acid
SYSTEMATIC NAME: 4-[[(2-pyridin-3-ylquinolin-4-yl)carbonylhydrazinylidene]methyl]benzoic acid
MOLECULAR FORMULA: C23H16N4O3
MOLECULAR WEIGHT: 396.39814
SMILES: C1=CC=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)NN=CC4=CC=C(C=C4)C(=O)O
Structure:
CAS RN: 5685-13-2
CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide
OPENEYE Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide
IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide
SYSTEMATIC NAME: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide
MOLECULAR FORMULA: C22H14ClN3O5S
MOLECULAR WEIGHT: 467.88166
SMILES: C1=CC=C(C(=C1)NC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl
Structure:
CAS RN: 6740-25-6
CAS Name: 3-(2-furanyl)-N-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)-2-propenamide
OPENEYE Name: 3-(2-furyl)-N-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)prop-2-enamide
IUPAC Name: 3-(furan-2-yl)-N-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)prop-2-enamide
SYSTEMATIC NAME: 3-(furan-2-yl)-N-(12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)prop-2-enamide
MOLECULAR FORMULA: C20H19N3O3
MOLECULAR WEIGHT: 349.38316
SMILES: C1CCC2=NC3=C(C=C(C=C3)NC(=O)C=CC4=CC=CO4)C(=O)N2CC1
Structure:
CAS RN: 5274-80-6
CAS Name: 2-[[(2,5-dimethylanilino)-oxomethyl]amino]-4-methylpentanoic acid methyl ester
OPENEYE Name: methyl 2-[(2,5-dimethylphenyl)carbamoylamino]-4-methyl-pentanoate
IUPAC Name: methyl 2-[(2,5-dimethylphenyl)carbamoylamino]-4-methylpentanoate
SYSTEMATIC NAME: methyl 2-[(2,5-dimethylphenyl)carbamoylamino]-4-methyl-pentanoate
MOLECULAR FORMULA: C16H24N2O3
MOLECULAR WEIGHT: 292.37336
SMILES: CC1=CC(=C(C=C1)C)NC(=O)NC(CC(C)C)C(=O)OC
Structure:
CAS RN: 5371-26-6
CAS Name: N-(2-methoxy-5-nitrophenyl)-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]acetamide
OPENEYE Name: N-(2-methoxy-5-nitro-phenyl)-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
IUPAC Name: N-(2-methoxy-5-nitrophenyl)-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
SYSTEMATIC NAME: N-(2-methoxy-5-nitro-phenyl)-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanamide
MOLECULAR FORMULA: C16H13N5O5S
MOLECULAR WEIGHT: 387.36992
SMILES: COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NN=C(O2)C3=CC=NC=C3
Structure:
CAS RN: 5389-97-9
CAS Name: 2-(2-methyl-1-benzimidazolyl)propanoic acid
OPENEYE Name: 2-(2-methylbenzimidazol-1-yl)propanoic acid
IUPAC Name: 2-(2-methylbenzimidazol-1-yl)propanoic acid
SYSTEMATIC NAME: 2-(2-methylbenzimidazol-1-yl)propanoic acid
MOLECULAR FORMULA: C11H12N2O2
MOLECULAR WEIGHT: 204.22518
SMILES: CC1=NC2=CC=CC=C2N1C(C)C(=O)O
Structure:
CAS RN: 753489-92-8
CAS Name: 2-(2-methyl-1-benzimidazolyl)propanoic acid
OPENEYE Name: 2-(2-methylbenzimidazol-1-yl)propanoic acid
IUPAC Name: 2-(2-methylbenzimidazol-1-yl)propanoic acid
SYSTEMATIC NAME: 2-(2-methylbenzimidazol-1-yl)propanoic acid
MOLECULAR FORMULA: C11H12N2O2
MOLECULAR WEIGHT: 204.22518
SMILES: CC1=NC2=CC=CC=C2N1C(C)C(=O)O
Structure:
CAS RN: 6027-88-9
CAS Name: 2-[cyclohexyl-(4-fluorophenyl)sulfonylamino]-N-[(4-fluorophenyl)methyl]-N-[(3-methyl-2-thiophenyl)methyl]acetamide
OPENEYE Name: 2-[cyclohexyl-(4-fluorophenyl)sulfonyl-amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methyl-2-thienyl)methyl]acetamide
IUPAC Name: 2-[cyclohexyl-(4-fluorophenyl)sulfonylamino]-N-[(4-fluorophenyl)methyl]-N-[(3-methylthiophen-2-yl)methyl]acetamide
SYSTEMATIC NAME: 2-[cyclohexyl-(4-fluorophenyl)sulfonyl-amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methylthiophen-2-yl)methyl]ethanamide
MOLECULAR FORMULA: C27H30F2N2O3S2
MOLECULAR WEIGHT: 532.665506
SMILES: CC1=C(SC=C1)CN(CC2=CC=C(C=C2)F)C(=O)CN(C3CCCCC3)S(=O)(=O)C4=CC=C(C=C4)F
Structure:
CAS RN: 6692-13-3
CAS Name: 2-(3,4-dichlorophenyl)acetic acid 2-(1-pyrrolidinyl)ethyl ester
OPENEYE Name: 2-pyrrolidin-1-ylethyl 2-(3,4-dichlorophenyl)acetate
IUPAC Name: 2-pyrrolidin-1-ylethyl 2-(3,4-dichlorophenyl)acetate
SYSTEMATIC NAME: 2-pyrrolidin-1-ylethyl 2-(3,4-dichlorophenyl)ethanoate
MOLECULAR FORMULA: C14H17Cl2NO2
MOLECULAR WEIGHT: 302.19628
SMILES: C1CCN(C1)CCOC(=O)CC2=CC(=C(C=C2)Cl)Cl
Structure:
CAS RN: 102567-19-1
CAS Name: 3-[[2-[[2-amino-5-(diaminomethylideneamino)-1-oxopentyl]amino]-1-oxo-3-phenylpropyl]amino]-4-[(1-carboxy-2-hydroxyethyl)amino]-4-oxobutanoic acid
OPENEYE Name: 3-[[2-[(2-amino-5-guanidino-pentanoyl)amino]-3-phenyl-propanoyl]amino]-4-[(1-carboxy-2-hydroxy-ethyl)amino]-4-oxo-butanoic acid
IUPAC Name: 3-[[2-[[2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-phenylpropanoyl]amino]-4-[(1-carboxy-2-hydroxyethyl)amino]-4-oxobutanoic acid
SYSTEMATIC NAME: 3-[[2-[[2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-3-phenyl-propanoyl]amino]-4-[[1,3-bis(oxidanyl)-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C22H33N7O8
MOLECULAR WEIGHT: 523.53952
SMILES: C1=CC=C(C=C1)CC(C(=O)NC(CC(=O)O)C(=O)NC(CO)C(=O)O)NC(=O)C(CCCN=C(N)N)N
Structure:
CAS RN: 90559-89-0
CAS Name: 2-amino-9-(2-oxolanyl)-3H-purine-6-thione
OPENEYE Name: 2-amino-9-tetrahydrofuran-2-yl-3H-purine-6-thione
IUPAC Name: 2-amino-9-(oxolan-2-yl)-3H-purine-6-thione
SYSTEMATIC NAME: 2-azanyl-9-(oxolan-2-yl)-3H-purine-6-thione
MOLECULAR FORMULA: C9H11N5OS
MOLECULAR WEIGHT: 237.28154
SMILES: C1CC(OC1)N2C=NC3=C2NC(=NC3=S)N
Structure:
CAS RN: 6411-37-6
CAS Name: 3-[[1-adamantyl(oxo)methyl]amino]-3-(4-tert-butylphenyl)propanoic acid
OPENEYE Name: 3-(adamantane-1-carbonylamino)-3-(4-tert-butylphenyl)propanoic acid
IUPAC Name: 3-(adamantane-1-carbonylamino)-3-(4-tert-butylphenyl)propanoic acid
SYSTEMATIC NAME: 3-(1-adamantylcarbonylamino)-3-(4-tert-butylphenyl)propanoic acid
MOLECULAR FORMULA: C24H33NO3
MOLECULAR WEIGHT: 383.52372
SMILES: CC(C)(C)C1=CC=C(C=C1)C(CC(=O)O)NC(=O)C23CC4CC(C2)CC(C4)C3
Structure:
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