(3S)-N-(2-methylsulfanylethyl)-6-oxidanylidene-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-(2-methylsulfanylethyl)-6-oxidanylidene-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Openeye Name: (3S)-N-(2-methylsulfanylethyl)-6-oxo-1-[2-(2-pyridyl)ethyl]piperidine-3-carboxamide CAS Name: (3S)-N-[2-(methylthio)ethyl]-6-oxo-1-[2-(2-pyridinyl)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2-methylsulfanylethyl)-6-oxo-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Traditional Name: (3S)-6-keto-N-[2-(methylthio)ethyl]-1-[2-(2-pyridyl)ethyl]nipecotamide Formula: C16H23N3O2S MolecularWeight: 321.43772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCNC(=O)C1CCC(=O)N(C1)CCC2=CC=CC=N2

Isomeric SMILES

CSCCNC(=O)[C@H]1CCC(=O)N(C1)CCC2=CC=CC=N2

InChI

InChI=1S/C16H23N3O2S/c1-22-11-9-18-16(21)13-5-6-15(20)19(12-13)10-7-14-4-2-3-8-17-14/h2-4,8,13H,5-7,9-12H2,1H3,(H,18,21)/t13-/m0/s1