N-butan-2-yl-8-chloranyl-6-ethyl-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-butan-2-yl-8-chloranyl-6-ethyl-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 8-chloro-6-ethyl-N-sec-butyl-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-butan-2-yl-8-chloro-6-ethyl-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-butan-2-yl-8-chloro-6-ethylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 8-chloro-6-ethyl-N-sec-butyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C20H21ClN2OS MolecularWeight: 372.91154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CC(=C2)C(=O)NC(C)CC)SC3=C1C=C(C=C3)Cl

Isomeric SMILES

CCC1=NC2=C(C=CC(=C2)C(=O)NC(C)CC)SC3=C1C=C(C=C3)Cl

InChI

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