1-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]piperidine-2-carboxamide

Systemtic Name: 1-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]piperidine-2-carboxamide Openeye Name: 1-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxo-ethyl]piperidine-2-carboxamide CAS Name: 1-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]-2-piperidinecarboxamide IUPAC Name: 1-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]piperidine-2-carboxamide Traditional Name: 1-[2-keto-2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethyl]pipecolinamide Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CN3CCCCC3C(=O)N

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CN3CCCCC3C(=O)N

InChI

InChI=1S/C18H25N3O2S/c1-13-9-11-21(14-6-2-3-8-16(14)24-13)17(22)12-20-10-5-4-7-15(20)18(19)23/h2-3,6,8,13,15H,4-5,7,9-12H2,1H3,(H2,19,23)