ethyl 4-(3-cyano-6-ethyl-5-methyl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(3-cyano-6-ethyl-5-methyl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[(3-cyano-6-ethyl-5-methyl-2-pyridyl)sulfanyl]-3-oxo-butanoate CAS Name: 4-[(3-cyano-6-ethyl-5-methyl-2-pyridinyl)thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(3-cyano-6-ethyl-5-methylpyridin-2-yl)sulfanyl-3-oxobutanoate Traditional Name: 4-[(3-cyano-6-ethyl-5-methyl-2-pyridyl)thio]-3-keto-butyric acid ethyl ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=N1)SCC(=O)CC(=O)OCC)C#N)C

Isomeric SMILES

CCC1=C(C=C(C(=N1)SCC(=O)CC(=O)OCC)C#N)C

InChI

InChI=1S/C15H18N2O3S/c1-4-13-10(3)6-11(8-16)15(17-13)21-9-12(18)7-14(19)20-5-2/h6H,4-5,7,9H2,1-3H3