CAS RN: 6606-32-2
CAS Name: 2-[4-(1-adamantyl)anilino]-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide
OPENEYE Name: 2-[4-(1-adamantyl)anilino]-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide
IUPAC Name: 2-[4-(1-adamantyl)anilino]-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide
SYSTEMATIC NAME: 2-[[4-(1-adamantyl)phenyl]amino]-N-[2-chloranyl-5-(trifluoromethyl)phenyl]propanamide
MOLECULAR FORMULA: C26H28ClF3N2O
MOLECULAR WEIGHT: 476.96153
SMILES: CC(C(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4
Structure:
CAS RN: 6606-31-1
CAS Name: N-(3-chloro-4-methoxyphenyl)-2-(2-methoxy-4-nitroanilino)acetamide
OPENEYE Name: N-(3-chloro-4-methoxy-phenyl)-2-(2-methoxy-4-nitro-anilino)acetamide
IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-(2-methoxy-4-nitroanilino)acetamide
SYSTEMATIC NAME: N-(3-chloranyl-4-methoxy-phenyl)-2-[(2-methoxy-4-nitro-phenyl)amino]ethanamide
MOLECULAR FORMULA: C16H16ClN3O5
MOLECULAR WEIGHT: 365.76834
SMILES: COC1=C(C=C(C=C1)NC(=O)CNC2=C(C=C(C=C2)[N+](=O)[O-])OC)Cl
Structure:
CAS RN: 6644-90-2
CAS Name: 2,6-dimethyl-4-(trichloromethyl)pyridine-3,5-dicarboxylic acid diethyl ester
OPENEYE Name: diethyl 2,6-dimethyl-4-(trichloromethyl)pyridine-3,5-dicarboxylate
IUPAC Name: diethyl 2,6-dimethyl-4-(trichloromethyl)pyridine-3,5-dicarboxylate
SYSTEMATIC NAME: diethyl 2,6-dimethyl-4-(trichloromethyl)pyridine-3,5-dicarboxylate
MOLECULAR FORMULA: C14H16Cl3NO4
MOLECULAR WEIGHT: 368.64014
SMILES: CCOC(=O)C1=C(N=C(C(=C1C(Cl)(Cl)Cl)C(=O)OCC)C)C
Structure:
CAS RN: 6644-89-9
CAS Name: 4-chloro-3-[(3-chlorophenyl)sulfamoyl]-N-(1-phenylethyl)benzamide
OPENEYE Name: 4-chloro-3-[(3-chlorophenyl)sulfamoyl]-N-(1-phenylethyl)benzamide
IUPAC Name: 4-chloro-3-[(3-chlorophenyl)sulfamoyl]-N-(1-phenylethyl)benzamide
SYSTEMATIC NAME: 4-chloranyl-3-[(3-chlorophenyl)sulfamoyl]-N-(1-phenylethyl)benzamide
MOLECULAR FORMULA: C21H18Cl2N2O3S
MOLECULAR WEIGHT: 449.35022
SMILES: CC(C1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NC3=CC(=CC=C3)Cl
Structure:
CAS RN: 6717-65-3
CAS Name: 3-[(2-methoxyphenyl)methyl]-2-(phenoxymethyl)-1H-benzimidazol-3-ium
OPENEYE Name: 3-[(2-methoxyphenyl)methyl]-2-(phenoxymethyl)-1H-benzimidazol-3-ium
IUPAC Name: 3-[(2-methoxyphenyl)methyl]-2-(phenoxymethyl)-1H-benzimidazol-3-ium
SYSTEMATIC NAME: 3-[(2-methoxyphenyl)methyl]-2-(phenoxymethyl)-1H-benzimidazol-3-ium
MOLECULAR FORMULA: C22H21N2O2+
MOLECULAR WEIGHT: 345.41434
SMILES: COC1=CC=CC=C1C[N+]2=C(NC3=CC=CC=C32)COC4=CC=CC=C4
Structure:
CAS RN: 6717-64-2
CAS Name: 2-[(4-methylphenoxy)methyl]-3-prop-2-enyl-1H-benzimidazol-3-ium
OPENEYE Name: 3-allyl-2-[(4-methylphenoxy)methyl]-1H-benzimidazol-3-ium
IUPAC Name: 2-[(4-methylphenoxy)methyl]-3-prop-2-enyl-1H-benzimidazol-3-ium
SYSTEMATIC NAME: 2-[(4-methylphenoxy)methyl]-3-prop-2-enyl-1H-benzimidazol-3-ium
MOLECULAR FORMULA: C18H19N2O+
MOLECULAR WEIGHT: 279.35626
SMILES: CC1=CC=C(C=C1)OCC2=[N+](C3=CC=CC=C3N2)CC=C
Structure:
CAS RN: 6352-43-8
CAS Name: N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]benzamide
OPENEYE Name: N-[[4-(1,1-dimethylpropyl)cyclohexylidene]amino]benzamide
IUPAC Name: N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]benzamide
SYSTEMATIC NAME: N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]benzamide
MOLECULAR FORMULA: C18H26N2O
MOLECULAR WEIGHT: 286.41184
SMILES: CCC(C)(C)C1CCC(=NNC(=O)C2=CC=CC=C2)CC1
Structure:
CAS RN: 5669-79-4
CAS Name: N,N-diethyl-4-[1-oxo-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)prop-2-enyl]benzenesulfonamide
OPENEYE Name: N,N-diethyl-4-[3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enoyl]benzenesulfonamide
IUPAC Name: N,N-diethyl-4-[3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoyl]benzenesulfonamide
SYSTEMATIC NAME: N,N-diethyl-4-[3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoyl]benzenesulfonamide
MOLECULAR FORMULA: C26H25N3O3S2
MOLECULAR WEIGHT: 491.625
SMILES: CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4
Structure:
CAS RN: 5669-18-1
CAS Name: 2-(4-phenyl-2-propan-2-yl-4-oxanyl)ethylammonium
OPENEYE Name: 2-(2-isopropyl-4-phenyl-tetrahydropyran-4-yl)ethylammonium
IUPAC Name: 2-(4-phenyl-2-propan-2-yloxan-4-yl)ethylazanium
SYSTEMATIC NAME: 2-(4-phenyl-2-propan-2-yl-oxan-4-yl)ethylazanium
MOLECULAR FORMULA: C16H26NO+
MOLECULAR WEIGHT: 248.38374
SMILES: CC(C)C1CC(CCO1)(CC[NH3+])C2=CC=CC=C2
Structure:
CAS RN: 103364-66-5
CAS Name: 2-amino-4-ethylsulfonylbutanoic acid
OPENEYE Name: 2-amino-4-ethylsulfonyl-butanoic acid
IUPAC Name: 2-amino-4-ethylsulfonylbutanoic acid
SYSTEMATIC NAME: 2-azanyl-4-ethylsulfonyl-butanoic acid
MOLECULAR FORMULA: C6H13NO4S
MOLECULAR WEIGHT: 195.23672
SMILES: CCS(=O)(=O)CCC(C(=O)O)N
Structure:
CAS RN: 6667-91-0
CAS Name: 1-(2,5-dimethoxyphenyl)-3-(2,6-dimethylphenyl)urea
OPENEYE Name: 1-(2,5-dimethoxyphenyl)-3-(2,6-dimethylphenyl)urea
IUPAC Name: 1-(2,5-dimethoxyphenyl)-3-(2,6-dimethylphenyl)urea
SYSTEMATIC NAME: 1-(2,5-dimethoxyphenyl)-3-(2,6-dimethylphenyl)urea
MOLECULAR FORMULA: C17H20N2O3
MOLECULAR WEIGHT: 300.3523
SMILES: CC1=C(C(=CC=C1)C)NC(=O)NC2=C(C=CC(=C2)OC)OC
Structure:
CAS RN: 6665-45-8
CAS Name: 3-nitro-4-octadecoxybenzenesulfonic acid
OPENEYE Name: 3-nitro-4-octadecoxy-benzenesulfonic acid
IUPAC Name: 3-nitro-4-octadecoxybenzenesulfonic acid
SYSTEMATIC NAME: 3-nitro-4-octadecoxy-benzenesulfonic acid
MOLECULAR FORMULA: C24H41NO6S
MOLECULAR WEIGHT: 471.65044
SMILES: CCCCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)O)[N+](=O)[O-]
Structure:
CAS RN: 6197-03-1
CAS Name: 4-[2-[[2-[methyl-(phenylmethyl)amino]-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]-1-piperidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 4-[2-[2-[benzyl(methyl)amino]-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]piperidine-1-carboxylate
IUPAC Name: ethyl 4-[2-[2-[benzyl(methyl)amino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]piperidine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-[2-[2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]piperidine-1-carboxylate
MOLECULAR FORMULA: C26H30N4O4S
MOLECULAR WEIGHT: 494.6058
SMILES: CCOC(=O)N1CCC(CC1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(C)CC4=CC=CC=C4
Structure:
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