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

Systemtic Name: 2-methyl-N-(4-methylpyridin-2-yl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: 2-methyl-N-(4-methyl-2-pyridyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: 2-methyl-N-(4-methyl-2-pyridinyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: 2-methyl-N-(4-methylpyridin-2-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: 4-keto-2-methyl-N-(4-methyl-2-pyridyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C16H17N3O3S2 MolecularWeight: 363.45448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O3S2/c1-10-5-6-17-15(7-10)19-24(21,22)12-3-4-14-13(9-12)18-16(20)8-11(2)23-14/h3-7,9,11H,8H2,1-2H3,(H,17,19)(H,18,20)