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

Systemtic Name: N-(3-methoxyphenyl)-3-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: N-(3-methoxyphenyl)-3-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: N-(3-methoxyphenyl)-3-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: N-(3-methoxyphenyl)-3-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: 4-keto-N-(3-methoxyphenyl)-3-methyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C17H18N2O4S2 MolecularWeight: 378.46582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CSC2=C(C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)OC)NC1=O

Isomeric SMILES

CC1CSC2=C(C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)OC)NC1=O

InChI

InChI=1S/C17H18N2O4S2/c1-11-10-24-16-7-6-14(9-15(16)18-17(11)20)25(21,22)19-12-4-3-5-13(8-12)23-2/h3-9,11,19H,10H2,1-2H3,(H,18,20)