methyl 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylpropanoate

Systemtic Name: methyl 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylpropanoate Openeye Name: methyl 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]propanoate CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]propanoic acid methyl ester IUPAC Name: methyl 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylpropanoate Traditional Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]propionic acid methyl ester Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SC(C)C(=O)OC)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC(C)C(=O)OC)C

InChI

InChI=1S/C12H14N2O2S/c1-7-5-8(2)14-11(10(7)6-13)17-9(3)12(15)16-4/h5,9H,1-4H3