(5-ethanoyl-2-methoxy-phenyl)methyl 2-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanyl]ethanoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 2-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanyl]ethanoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]acetate CAS Name: 2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)thio]acetic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]acetate Traditional Name: 2-[(3-cyano-6-keto-4-methyl-1H-pyridin-2-yl)thio]acetic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NC(=C1C#N)SCC(=O)OCC2=C(C=CC(=C2)C(=O)C)OC

Isomeric SMILES

CC1=CC(=O)NC(=C1C#N)SCC(=O)OCC2=C(C=CC(=C2)C(=O)C)OC

InChI

InChI=1S/C19H18N2O5S/c1-11-6-17(23)21-19(15(11)8-20)27-10-18(24)26-9-14-7-13(12(2)22)4-5-16(14)25-3/h4-7H,9-10H2,1-3H3,(H,21,23)