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

Systemtic Name: 6-oxidanylidene-N-(2-phenylpropyl)-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 6-oxo-N-(2-phenylpropyl)-5H-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 6-oxo-N-(2-phenylpropyl)-5H-benzo[b][1,4]benzothiazepine-3-carboxamide IUPAC Name: 6-oxo-N-(2-phenylpropyl)-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 6-keto-N-(2-phenylpropyl)-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C23H20N2O2S MolecularWeight: 388.4821

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2)C4=CC=CC=C4

Isomeric SMILES

CC(CNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2)C4=CC=CC=C4

InChI

InChI=1S/C23H20N2O2S/c1-15(16-7-3-2-4-8-16)14-24-22(26)17-11-12-21-19(13-17)25-23(27)18-9-5-6-10-20(18)28-21/h2-13,15H,14H2,1H3,(H,24,26)(H,25,27)