ethyl 4-[[3-cyano-4-(methoxymethyl)-6-methyl-pyridin-2-yl]sulfanylmethyl]benzoate

Systemtic Name: ethyl 4-[[3-cyano-4-(methoxymethyl)-6-methyl-pyridin-2-yl]sulfanylmethyl]benzoate Openeye Name: ethyl 4-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridyl]sulfanylmethyl]benzoate CAS Name: 4-[[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]thio]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanylmethyl]benzoate Traditional Name: 4-[[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridyl]thio]methyl]benzoic acid ethyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CSC2=C(C(=CC(=N2)C)COC)C#N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CSC2=C(C(=CC(=N2)C)COC)C#N

InChI

InChI=1S/C19H20N2O3S/c1-4-24-19(22)15-7-5-14(6-8-15)12-25-18-17(10-20)16(11-23-3)9-13(2)21-18/h5-9H,4,11-12H2,1-3H3