methyl 2-(3-cyano-4-methyl-6-phenyl-pyridin-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(3-cyano-4-methyl-6-phenyl-pyridin-2-yl)sulfanylethanoate Openeye Name: methyl 2-[(3-cyano-4-methyl-6-phenyl-2-pyridyl)sulfanyl]acetate CAS Name: 2-[(3-cyano-4-methyl-6-phenyl-2-pyridinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(3-cyano-4-methyl-6-phenylpyridin-2-yl)sulfanylacetate Traditional Name: 2-[(3-cyano-4-methyl-6-phenyl-2-pyridyl)thio]acetic acid methyl ester Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C16H14N2O2S/c1-11-8-14(12-6-4-3-5-7-12)18-16(13(11)9-17)21-10-15(19)20-2/h3-8H,10H2,1-2H3