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

Systemtic Name: 6-ethyl-N-(1-phenylethyl)benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 6-ethyl-N-(1-phenylethyl)benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 6-ethyl-N-(1-phenylethyl)-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: 6-ethyl-N-(1-phenylethyl)benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 6-ethyl-N-(1-phenylethyl)benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C24H22N2OS MolecularWeight: 386.50928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CC(=C2)C(=O)NC(C)C3=CC=CC=C3)SC4=CC=CC=C41

Isomeric SMILES

CCC1=NC2=C(C=CC(=C2)C(=O)NC(C)C3=CC=CC=C3)SC4=CC=CC=C41

InChI

InChI=1S/C24H22N2OS/c1-3-20-19-11-7-8-12-22(19)28-23-14-13-18(15-21(23)26-20)24(27)25-16(2)17-9-5-4-6-10-17/h4-16H,3H2,1-2H3,(H,25,27)