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

Systemtic Name: 3-methyl-4-oxidanylidene-N-(phenylmethyl)-N-propan-2-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: N-benzyl-N-isopropyl-3-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: 3-methyl-4-oxo-N-(phenylmethyl)-N-propan-2-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: N-benzyl-3-methyl-4-oxo-N-propan-2-yl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: N-benzyl-N-isopropyl-4-keto-3-methyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CC1CSC2=C(C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)C(C)C)NC1=O

Isomeric SMILES

CC1CSC2=C(C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)C(C)C)NC1=O

InChI

InChI=1S/C20H24N2O3S2/c1-14(2)22(12-16-7-5-4-6-8-16)27(24,25)17-9-10-19-18(11-17)21-20(23)15(3)13-26-19/h4-11,14-15H,12-13H2,1-3H3,(H,21,23)