4-[(4-chlorophenyl)methyl]-N-cyclohexyl-3-methyl-5-oxidanylidene-2H-1,4-benzothiazepine-3-carboxamide

Systemtic Name: 4-[(4-chlorophenyl)methyl]-N-cyclohexyl-3-methyl-5-oxidanylidene-2H-1,4-benzothiazepine-3-carboxamide Openeye Name: 4-[(4-chlorophenyl)methyl]-N-cyclohexyl-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide CAS Name: 4-[(4-chlorophenyl)methyl]-N-cyclohexyl-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide IUPAC Name: 4-[(4-chlorophenyl)methyl]-N-cyclohexyl-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide Traditional Name: 4-(4-chlorobenzyl)-N-cyclohexyl-5-keto-3-methyl-2H-1,4-benzothiazepine-3-carboxamide Formula: C24H27ClN2O2S MolecularWeight: 443.00138

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)Cl)C(=O)NC4CCCCC4

Isomeric SMILES

CC1(CSC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)Cl)C(=O)NC4CCCCC4

InChI

InChI=1S/C24H27ClN2O2S/c1-24(23(29)26-19-7-3-2-4-8-19)16-30-21-10-6-5-9-20(21)22(28)27(24)15-17-11-13-18(25)14-12-17/h5-6,9-14,19H,2-4,7-8,15-16H2,1H3,(H,26,29)