2-methyl-4-oxidanylidene-N-(phenylmethyl)-N-propan-2-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide

Systemtic Name: 2-methyl-4-oxidanylidene-N-(phenylmethyl)-N-propan-2-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: N-benzyl-N-isopropyl-2-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: 2-methyl-4-oxo-N-(phenylmethyl)-N-propan-2-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: N-benzyl-2-methyl-4-oxo-N-propan-2-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: N-benzyl-N-isopropyl-4-keto-2-methyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)N(CC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)N(CC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C20H24N2O3S2/c1-14(2)22(13-16-7-5-4-6-8-16)27(24,25)17-9-10-19-18(12-17)21-20(23)11-15(3)26-19/h4-10,12,14-15H,11,13H2,1-3H3,(H,21,23)