3-[[4-[2-(2-methylsulfonylthiophen-3-yl)ethyl]piperidin-1-yl]methyl]-1H-pyridin-2-one

Systemtic Name: 3-[[4-[2-(2-methylsulfonylthiophen-3-yl)ethyl]piperidin-1-yl]methyl]-1H-pyridin-2-one Openeye Name: 3-[[4-[2-(2-methylsulfonyl-3-thienyl)ethyl]-1-piperidyl]methyl]-1H-pyridin-2-one CAS Name: 3-[[4-[2-(2-methylsulfonyl-3-thiophenyl)ethyl]-1-piperidinyl]methyl]-1H-pyridin-2-one IUPAC Name: 3-[[4-[2-(2-methylsulfonylthiophen-3-yl)ethyl]piperidin-1-yl]methyl]-1H-pyridin-2-one Traditional Name: 3-[[4-[2-(2-mesyl-3-thienyl)ethyl]piperidino]methyl]-2-pyridone Formula: C18H24N2O3S2 MolecularWeight: 380.52476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CS1)CCC2CCN(CC2)CC3=CC=CNC3=O

Isomeric SMILES

CS(=O)(=O)C1=C(C=CS1)CCC2CCN(CC2)CC3=CC=CNC3=O

InChI

InChI=1S/C18H24N2O3S2/c1-25(22,23)18-15(8-12-24-18)5-4-14-6-10-20(11-7-14)13-16-3-2-9-19-17(16)21/h2-3,8-9,12,14H,4-7,10-11,13H2,1H3,(H,19,21)