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

Systemtic Name: N-(3,4-dimethylphenyl)-N,2-dimethyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: N-(3,4-dimethylphenyl)-N,2-dimethyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: N-(3,4-dimethylphenyl)-N,2-dimethyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: N-(3,4-dimethylphenyl)-N,2-dimethyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: N-(3,4-dimethylphenyl)-4-keto-N,2-dimethyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C19H22N2O3S2 MolecularWeight: 390.51958

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O3S2/c1-12-5-6-15(9-13(12)2)21(4)26(23,24)16-7-8-18-17(11-16)20-19(22)10-14(3)25-18/h5-9,11,14H,10H2,1-4H3,(H,20,22)