N,2-dimethyl-N-(4-methylphenyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide

Systemtic Name: N,2-dimethyl-N-(4-methylphenyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: N,2-dimethyl-4-oxo-N-(p-tolyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: N,2-dimethyl-N-(4-methylphenyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: N,2-dimethyl-N-(4-methylphenyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: 4-keto-N,2-dimethyl-N-(p-tolyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C18H20N2O3S2 MolecularWeight: 376.493

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3S2/c1-12-4-6-14(7-5-12)20(3)25(22,23)15-8-9-17-16(11-15)19-18(21)10-13(2)24-17/h4-9,11,13H,10H2,1-3H3,(H,19,21)