2-methyl-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)piperidine-1-carboxamide

Systemtic Name: 2-methyl-N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)piperidine-1-carboxamide Openeye Name: 2-methyl-N-(5-methyl-6-oxo-benzo[b][1,4]benzothiazepin-3-yl)piperidine-1-carboxamide CAS Name: 2-methyl-N-(5-methyl-6-oxo-3-benzo[b][1,4]benzothiazepinyl)-1-piperidinecarboxamide IUPAC Name: 2-methyl-N-(5-methyl-6-oxobenzo[b][1,4]benzothiazepin-3-yl)piperidine-1-carboxamide Traditional Name: N-(6-keto-5-methyl-benzo[b][1,4]benzothiazepin-3-yl)-2-methyl-piperidine-1-carboxamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)NC2=CC3=C(C=C2)SC4=CC=CC=C4C(=O)N3C

Isomeric SMILES

CC1CCCCN1C(=O)NC2=CC3=C(C=C2)SC4=CC=CC=C4C(=O)N3C

InChI

InChI=1S/C21H23N3O2S/c1-14-7-5-6-12-24(14)21(26)22-15-10-11-19-17(13-15)23(2)20(25)16-8-3-4-9-18(16)27-19/h3-4,8-11,13-14H,5-7,12H2,1-2H3,(H,22,26)