ethyl 2-(3-cyano-6-methyl-pyridin-2-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(3-cyano-6-methyl-pyridin-2-yl)sulfanylethanoate Openeye Name: ethyl 2-[(3-cyano-6-methyl-2-pyridyl)sulfanyl]acetate CAS Name: 2-[(3-cyano-6-methyl-2-pyridinyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(3-cyano-6-methylpyridin-2-yl)sulfanylacetate Traditional Name: 2-[(3-cyano-6-methyl-2-pyridyl)thio]acetic acid ethyl ester Formula: C11H12N2O2S MolecularWeight: 236.29018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O2S/c1-3-15-10(14)7-16-11-9(6-12)5-4-8(2)13-11/h4-5H,3,7H2,1-2H3