ethyl 5-cyano-2-methyl-6-(oxolan-2-ylmethylsulfanyl)pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-(oxolan-2-ylmethylsulfanyl)pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-(tetrahydrofuran-2-ylmethylsulfanyl)pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-(2-oxolanylmethylthio)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-(oxolan-2-ylmethylsulfanyl)pyridine-3-carboxylate Traditional Name: 5-cyano-2-methyl-6-(tetrahydrofurfurylthio)nicotinic acid ethyl ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2CCCO2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2CCCO2)C

InChI

InChI=1S/C15H18N2O3S/c1-3-19-15(18)13-7-11(8-16)14(17-10(13)2)21-9-12-5-4-6-20-12/h7,12H,3-6,9H2,1-2H3