[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidenepentanoate

Systemtic Name: [2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidenepentanoate Openeye Name: [2-(2-methylsulfanylanilino)-2-oxo-ethyl] 4-oxopentanoate CAS Name: 4-oxopentanoic acid [2-[2-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfanylanilino)-2-oxoethyl] 4-oxopentanoate Traditional Name: 4-ketovaleric acid [2-keto-2-[2-(methylthio)anilino]ethyl] ester Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)OCC(=O)NC1=CC=CC=C1SC

Isomeric SMILES

CC(=O)CCC(=O)OCC(=O)NC1=CC=CC=C1SC

InChI

InChI=1S/C14H17NO4S/c1-10(16)7-8-14(18)19-9-13(17)15-11-5-3-4-6-12(11)20-2/h3-6H,7-9H2,1-2H3,(H,15,17)