methyl 2-[(3S,4S)-3-ethanoyl-2-oxidanylidene-1-(phenylmethyl)-3,4-dihydropyridin-4-yl]-2-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(3S,4S)-3-ethanoyl-2-oxidanylidene-1-(phenylmethyl)-3,4-dihydropyridin-4-yl]-2-methylsulfanyl-butanoate Openeye Name: methyl 2-[(3S,4S)-3-acetyl-1-benzyl-2-oxo-3,4-dihydropyridin-4-yl]-2-methylsulfanyl-butanoate CAS Name: 2-[(3S,4S)-3-acetyl-2-oxo-1-(phenylmethyl)-3,4-dihydropyridin-4-yl]-2-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(3S,4S)-3-acetyl-1-benzyl-2-oxo-3,4-dihydropyridin-4-yl]-2-methylsulfanylbutanoate Traditional Name: 2-[(3S,4S)-3-acetyl-1-benzyl-2-keto-3,4-dihydropyridin-4-yl]-2-(methylthio)butyric acid methyl ester Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1C=CN(C(=O)C1C(=O)C)CC2=CC=CC=C2)(C(=O)OC)SC

Isomeric SMILES

CCC([C@H]1C=CN(C(=O)[C@@H]1C(=O)C)CC2=CC=CC=C2)(C(=O)OC)SC

InChI

InChI=1S/C20H25NO4S/c1-5-20(26-4,19(24)25-3)16-11-12-21(18(23)17(16)14(2)22)13-15-9-7-6-8-10-15/h6-12,16-17H,5,13H2,1-4H3/t16-,17+,20?/m0/s1