[pyridin-3-yl(sulfanyl)methyl] ethanoate

Systemtic Name: [pyridin-3-yl(sulfanyl)methyl] ethanoate Openeye Name: [3-pyridyl(sulfanyl)methyl] acetate CAS Name: acetic acid [mercapto(3-pyridinyl)methyl] ester IUPAC Name: [pyridin-3-yl(sulfanyl)methyl] acetate Traditional Name: acetic acid [mercapto(3-pyridyl)methyl] ester Formula: C8H9NO2S MolecularWeight: 183.22756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CN=CC=C1)S

Isomeric SMILES

CC(=O)OC(C1=CN=CC=C1)S

InChI

InChI=1S/C8H9NO2S/c1-6(10)11-8(12)7-3-2-4-9-5-7/h2-5,8,12H,1H3