8-chloranyl-6-methyl-N-(1-phenylethyl)benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 8-chloranyl-6-methyl-N-(1-phenylethyl)benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 8-chloro-6-methyl-N-(1-phenylethyl)benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 8-chloro-6-methyl-N-(1-phenylethyl)-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: 8-chloro-6-methyl-N-(1-phenylethyl)benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 8-chloro-6-methyl-N-(1-phenylethyl)benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C23H19ClN2OS MolecularWeight: 406.92776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)C(=O)NC(C)C3=CC=CC=C3)SC4=C1C=C(C=C4)Cl

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)C(=O)NC(C)C3=CC=CC=C3)SC4=C1C=C(C=C4)Cl

InChI

InChI=1S/C23H19ClN2OS/c1-14(16-6-4-3-5-7-16)26-23(27)17-8-10-22-20(12-17)25-15(2)19-13-18(24)9-11-21(19)28-22/h3-14H,1-2H3,(H,26,27)