1-[1-(4-methylsulfanylphenyl)-2-pyridin-2-yl-ethyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[1-(4-methylsulfanylphenyl)-2-pyridin-2-yl-ethyl]piperidine-2-carboxylic acid Openeye Name: 1-[1-(4-methylsulfanylphenyl)-2-(2-pyridyl)ethyl]piperidine-2-carboxylic acid CAS Name: 1-[1-[4-(methylthio)phenyl]-2-(2-pyridinyl)ethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[1-(4-methylsulfanylphenyl)-2-pyridin-2-ylethyl]piperidine-2-carboxylic acid Traditional Name: 1-[1-[4-(methylthio)phenyl]-2-(2-pyridyl)ethyl]pipecolinic acid Formula: C20H24N2O2S MolecularWeight: 356.48176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(CC2=CC=CC=N2)N3CCCCC3C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(CC2=CC=CC=N2)N3CCCCC3C(=O)O

InChI

InChI=1S/C20H24N2O2S/c1-25-17-10-8-15(9-11-17)19(14-16-6-2-4-12-21-16)22-13-5-3-7-18(22)20(23)24/h2,4,6,8-12,18-19H,3,5,7,13-14H2,1H3,(H,23,24)