methyl 2-[3-methyl-2-oxidanylidene-1-(phenylmethyl)pyridin-4-yl]-2-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[3-methyl-2-oxidanylidene-1-(phenylmethyl)pyridin-4-yl]-2-methylsulfanyl-butanoate Openeye Name: methyl 2-(1-benzyl-3-methyl-2-oxo-4-pyridyl)-2-methylsulfanyl-butanoate CAS Name: 2-[3-methyl-2-oxo-1-(phenylmethyl)-4-pyridinyl]-2-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-(1-benzyl-3-methyl-2-oxopyridin-4-yl)-2-methylsulfanylbutanoate Traditional Name: 2-(1-benzyl-2-keto-3-methyl-4-pyridyl)-2-(methylthio)butyric acid methyl ester Formula: C19H23NO3S MolecularWeight: 345.45582

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C(=O)N(C=C1)CC2=CC=CC=C2)C)(C(=O)OC)SC

Isomeric SMILES

CCC(C1=C(C(=O)N(C=C1)CC2=CC=CC=C2)C)(C(=O)OC)SC

InChI

InChI=1S/C19H23NO3S/c1-5-19(24-4,18(22)23-3)16-11-12-20(17(21)14(16)2)13-15-9-7-6-8-10-15/h6-12H,5,13H2,1-4H3