propan-2-yl 2-(3-cyano-4-methyl-pyridin-2-yl)sulfanylethanoate

Systemtic Name: propan-2-yl 2-(3-cyano-4-methyl-pyridin-2-yl)sulfanylethanoate Openeye Name: isopropyl 2-[(3-cyano-4-methyl-2-pyridyl)sulfanyl]acetate CAS Name: 2-[(3-cyano-4-methyl-2-pyridinyl)thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(3-cyano-4-methylpyridin-2-yl)sulfanylacetate Traditional Name: 2-[(3-cyano-4-methyl-2-pyridyl)thio]acetic acid isopropyl ester Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1)SCC(=O)OC(C)C)C#N

Isomeric SMILES

CC1=C(C(=NC=C1)SCC(=O)OC(C)C)C#N

InChI

InChI=1S/C12H14N2O2S/c1-8(2)16-11(15)7-17-12-10(6-13)9(3)4-5-14-12/h4-5,8H,7H2,1-3H3