N-butyl-8-chloranyl-6-ethyl-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-butyl-8-chloranyl-6-ethyl-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-butyl-8-chloro-6-ethyl-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-butyl-8-chloro-6-ethyl-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-butyl-8-chloro-6-ethylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-butyl-8-chloro-6-ethyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C20H21ClN2OS MolecularWeight: 372.91154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC2=C(C=C1)SC3=C(C=C(C=C3)Cl)C(=N2)CC

Isomeric SMILES

CCCCNC(=O)C1=CC2=C(C=C1)SC3=C(C=C(C=C3)Cl)C(=N2)CC

InChI

InChI=1S/C20H21ClN2OS/c1-3-5-10-22-20(24)13-6-8-19-17(11-13)23-16(4-2)15-12-14(21)7-9-18(15)25-19/h6-9,11-12H,3-5,10H2,1-2H3,(H,22,24)