N-(2,2-dimethoxyethyl)-6-ethyl-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-(2,2-dimethoxyethyl)-6-ethyl-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-(2,2-dimethoxyethyl)-6-ethyl-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-(2,2-dimethoxyethyl)-6-ethyl-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-(2,2-dimethoxyethyl)-6-ethylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-(2,2-dimethoxyethyl)-6-ethyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CC(=C2)C(=O)NCC(OC)OC)SC3=CC=CC=C31

Isomeric SMILES

CCC1=NC2=C(C=CC(=C2)C(=O)NCC(OC)OC)SC3=CC=CC=C31

InChI

InChI=1S/C20H22N2O3S/c1-4-15-14-7-5-6-8-17(14)26-18-10-9-13(11-16(18)22-15)20(23)21-12-19(24-2)25-3/h5-11,19H,4,12H2,1-3H3,(H,21,23)