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

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-6-oxidanylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-6-oxo-5H-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-6-oxo-5H-benzo[b][1,4]benzothiazepine-3-carboxamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-6-oxo-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-6-keto-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C24H19N3O2S MolecularWeight: 413.49156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C3=CC4=C(C=C3)SC5=CC=CC=C5C(=O)N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C3=CC4=C(C=C3)SC5=CC=CC=C5C(=O)N4

InChI

InChI=1S/C24H19N3O2S/c28-23(25-12-11-16-14-26-19-7-3-1-5-17(16)19)15-9-10-22-20(13-15)27-24(29)18-6-2-4-8-21(18)30-22/h1-10,13-14,26H,11-12H2,(H,25,28)(H,27,29)