propyl 2-(3-cyano-4-methyl-pyridin-2-yl)sulfanylethanoate

Systemtic Name: propyl 2-(3-cyano-4-methyl-pyridin-2-yl)sulfanylethanoate Openeye Name: propyl 2-[(3-cyano-4-methyl-2-pyridyl)sulfanyl]acetate CAS Name: 2-[(3-cyano-4-methyl-2-pyridinyl)thio]acetic acid propyl ester IUPAC Name: propyl 2-(3-cyano-4-methylpyridin-2-yl)sulfanylacetate Traditional Name: 2-[(3-cyano-4-methyl-2-pyridyl)thio]acetic acid propyl ester Formula: C12H14N2O2S MolecularWeight: 250.31676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CSC1=NC=CC(=C1C#N)C

Isomeric SMILES

CCCOC(=O)CSC1=NC=CC(=C1C#N)C

InChI

InChI=1S/C12H14N2O2S/c1-3-6-16-11(15)8-17-12-10(7-13)9(2)4-5-14-12/h4-5H,3,6,8H2,1-2H3