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

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

CC1CSC2=C(C=C(C=C2)S(=O)(=O)NC3=NC=C(C=C3)C)NC1=O

Isomeric SMILES

CC1CSC2=C(C=C(C=C2)S(=O)(=O)NC3=NC=C(C=C3)C)NC1=O

InChI

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