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

Systemtic Name: 2-methyl-4-oxidanylidene-N-(3,4,5-trimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: 2-methyl-4-oxo-N-(3,4,5-trimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: 2-methyl-4-oxo-N-(3,4,5-trimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: 2-methyl-4-oxo-N-(3,4,5-trimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: 4-keto-2-methyl-N-(3,4,5-trimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C19H22N2O6S2 MolecularWeight: 438.51778

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)NC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)NC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C19H22N2O6S2/c1-11-7-18(22)20-14-10-13(5-6-17(14)28-11)29(23,24)21-12-8-15(25-2)19(27-4)16(9-12)26-3/h5-6,8-11,21H,7H2,1-4H3,(H,20,22)