1-[2-[2-cyanoethyl(phenyl)amino]-2-oxidanylidene-ethyl]-N-(6-methylpyridin-2-yl)piperidine-3-carboxamide

Systemtic Name: 1-[2-[2-cyanoethyl(phenyl)amino]-2-oxidanylidene-ethyl]-N-(6-methylpyridin-2-yl)piperidine-3-carboxamide Openeye Name: 1-[2-[N-(2-cyanoethyl)anilino]-2-oxo-ethyl]-N-(6-methyl-2-pyridyl)piperidine-3-carboxamide CAS Name: 1-[2-[N-(2-cyanoethyl)anilino]-2-oxoethyl]-N-(6-methyl-2-pyridinyl)-3-piperidinecarboxamide IUPAC Name: 1-[2-[N-(2-cyanoethyl)anilino]-2-oxoethyl]-N-(6-methylpyridin-2-yl)piperidine-3-carboxamide Traditional Name: 1-[2-[N-(2-cyanoethyl)anilino]-2-keto-ethyl]-N-(6-methyl-2-pyridyl)nipecotamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)NC(=O)C2CCCN(C2)CC(=O)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC=C1)NC(=O)C2CCCN(C2)CC(=O)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C23H27N5O2/c1-18-8-5-12-21(25-18)26-23(30)19-9-6-14-27(16-19)17-22(29)28(15-7-13-24)20-10-3-2-4-11-20/h2-5,8,10-12,19H,6-7,9,14-17H2,1H3,(H,25,26,30)