methyl 5-cyano-2-(dimethoxymethyl)-6-prop-2-enylsulfanyl-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-2-(dimethoxymethyl)-6-prop-2-enylsulfanyl-pyridine-3-carboxylate Openeye Name: methyl 6-allylsulfanyl-5-cyano-2-(dimethoxymethyl)pyridine-3-carboxylate CAS Name: 5-cyano-2-(dimethoxymethyl)-6-(prop-2-enylthio)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-2-(dimethoxymethyl)-6-prop-2-enylsulfanylpyridine-3-carboxylate Traditional Name: 6-(allylthio)-5-cyano-2-(dimethoxymethyl)nicotinic acid methyl ester Formula: C14H16N2O4S MolecularWeight: 308.35284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(C1=C(C=C(C(=N1)SCC=C)C#N)C(=O)OC)OC

Isomeric SMILES

COC(C1=C(C=C(C(=N1)SCC=C)C#N)C(=O)OC)OC

InChI

InChI=1S/C14H16N2O4S/c1-5-6-21-12-9(8-15)7-10(13(17)18-2)11(16-12)14(19-3)20-4/h5,7,14H,1,6H2,2-4H3