[6-(phenylmethylsulfanyl)pyridin-2-yl] methanesulfonate

Systemtic Name: [6-(phenylmethylsulfanyl)pyridin-2-yl] methanesulfonate Openeye Name: (6-benzylsulfanyl-2-pyridyl) methanesulfonate CAS Name: methanesulfonic acid [6-(phenylmethylthio)-2-pyridinyl] ester IUPAC Name: (6-benzylsulfanylpyridin-2-yl) methanesulfonate Traditional Name: methanesulfonic acid [6-(benzylthio)-2-pyridyl] ester Formula: C13H13NO3S2 MolecularWeight: 295.37722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=NC(=CC=C1)SCC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)OC1=NC(=CC=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C13H13NO3S2/c1-19(15,16)17-12-8-5-9-13(14-12)18-10-11-6-3-2-4-7-11/h2-9H,10H2,1H3