ethyl 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-3-oxo-butanoate CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-3-oxobutanoate Traditional Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-3-keto-butyric acid ethyl ester Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)SC1=C(C(=CC(=N1)C)C)C#N

Isomeric SMILES

CCOC(=O)C(C(=O)C)SC1=C(C(=CC(=N1)C)C)C#N

InChI

InChI=1S/C14H16N2O3S/c1-5-19-14(18)12(10(4)17)20-13-11(7-15)8(2)6-9(3)16-13/h6,12H,5H2,1-4H3