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

Systemtic Name: N-cyclohexyl-3-methyl-5-oxidanylidene-4-(phenylmethyl)-2H-1,4-benzothiazepine-3-carboxamide Openeye Name: 4-benzyl-N-cyclohexyl-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide CAS Name: N-cyclohexyl-3-methyl-5-oxo-4-(phenylmethyl)-2H-1,4-benzothiazepine-3-carboxamide IUPAC Name: 4-benzyl-N-cyclohexyl-3-methyl-5-oxo-2H-1,4-benzothiazepine-3-carboxamide Traditional Name: 4-benzyl-N-cyclohexyl-5-keto-3-methyl-2H-1,4-benzothiazepine-3-carboxamide Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N2O2S/c1-24(23(28)25-19-12-6-3-7-13-19)17-29-21-15-9-8-14-20(21)22(27)26(24)16-18-10-4-2-5-11-18/h2,4-5,8-11,14-15,19H,3,6-7,12-13,16-17H2,1H3,(H,25,28)