N-(2,2-diethoxyethyl)-6-oxidanylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-(2,2-diethoxyethyl)-6-oxidanylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-(2,2-diethoxyethyl)-6-oxo-5H-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-(2,2-diethoxyethyl)-6-oxo-5H-benzo[b][1,4]benzothiazepine-3-carboxamide IUPAC Name: N-(2,2-diethoxyethyl)-6-oxo-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-(2,2-diethoxyethyl)-6-keto-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2)OCC

Isomeric SMILES

CCOC(CNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2)OCC

InChI

InChI=1S/C20H22N2O4S/c1-3-25-18(26-4-2)12-21-19(23)13-9-10-17-15(11-13)22-20(24)14-7-5-6-8-16(14)27-17/h5-11,18H,3-4,12H2,1-2H3,(H,21,23)(H,22,24)