propyl 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylethanoate

Systemtic Name: propyl 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylethanoate Openeye Name: propyl 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]acetate CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]acetic acid propyl ester IUPAC Name: propyl 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetate Traditional Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]acetic acid propyl ester Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O2S/c1-4-5-17-12(16)8-18-13-11(7-14)9(2)6-10(3)15-13/h6H,4-5,8H2,1-3H3