propyl 5-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: propyl 5-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: propyl 5-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]methyl]-2-furancarboxylic acid propyl ester IUPAC Name: propyl 5-[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(3-cyano-4,6-dimethyl-2-pyridyl)thio]methyl]furan-2-carboxylic acid propyl ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(O1)CSC2=C(C(=CC(=N2)C)C)C#N

Isomeric SMILES

CCCOC(=O)C1=CC=C(O1)CSC2=C(C(=CC(=N2)C)C)C#N

InChI

InChI=1S/C17H18N2O3S/c1-4-7-21-17(20)15-6-5-13(22-15)10-23-16-14(9-18)11(2)8-12(3)19-16/h5-6,8H,4,7,10H2,1-3H3