propan-2-yl 2-[(3-cyano-6-methyl-4-oxidanylidene-1H-pyridin-2-yl)sulfanyl]ethanoate

Systemtic Name: propan-2-yl 2-[(3-cyano-6-methyl-4-oxidanylidene-1H-pyridin-2-yl)sulfanyl]ethanoate Openeye Name: isopropyl 2-[(3-cyano-6-methyl-4-oxo-1H-pyridin-2-yl)sulfanyl]acetate CAS Name: 2-[(3-cyano-6-methyl-4-oxo-1H-pyridin-2-yl)thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(3-cyano-6-methyl-4-oxo-1H-pyridin-2-yl)sulfanyl]acetate Traditional Name: 2-[(3-cyano-4-keto-6-methyl-1H-pyridin-2-yl)thio]acetic acid isopropyl ester Formula: C12H14N2O3S MolecularWeight: 266.31616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1)SCC(=O)OC(C)C)C#N

Isomeric SMILES

CC1=CC(=O)C(=C(N1)SCC(=O)OC(C)C)C#N

InChI

InChI=1S/C12H14N2O3S/c1-7(2)17-11(16)6-18-12-9(5-13)10(15)4-8(3)14-12/h4,7H,6H2,1-3H3,(H,14,15)