6-oxidanylidene-5-(phenylmethyl)-N-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 6-oxidanylidene-5-(phenylmethyl)-N-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 5-benzyl-6-oxo-N-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 6-oxo-5-(phenylmethyl)-N-propyl-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: 5-benzyl-6-oxo-N-propylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 5-benzyl-6-keto-N-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C24H22N2O2S MolecularWeight: 402.50868

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

CCCNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C24H22N2O2S/c1-2-14-25-23(27)18-12-13-22-20(15-18)26(16-17-8-4-3-5-9-17)24(28)19-10-6-7-11-21(19)29-22/h3-13,15H,2,14,16H2,1H3,(H,25,27)