ethyl 2-(3-cyanopyridin-2-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(3-cyanopyridin-2-yl)sulfanylethanoate Openeye Name: ethyl 2-[(3-cyano-2-pyridyl)sulfanyl]acetate CAS Name: 2-[(3-cyano-2-pyridinyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(3-cyanopyridin-2-yl)sulfanylacetate Traditional Name: 2-[(3-cyano-2-pyridyl)thio]acetic acid ethyl ester Formula: C10H10N2O2S MolecularWeight: 222.2636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=CC=N1)C#N

Isomeric SMILES

CCOC(=O)CSC1=C(C=CC=N1)C#N

InChI

InChI=1S/C10H10N2O2S/c1-2-14-9(13)7-15-10-8(6-11)4-3-5-12-10/h3-5H,2,7H2,1H3