[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: [2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: [2-(3-methylsulfanylanilino)-2-oxo-ethyl] 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid [2-[3-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfanylanilino)-2-oxoethyl] 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid [2-keto-2-[3-(methylthio)anilino]ethyl] ester Formula: C17H17NO4S2 MolecularWeight: 363.45118

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)COC(=O)CCC(=O)C2=CC=CS2

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)COC(=O)CCC(=O)C2=CC=CS2

InChI

InChI=1S/C17H17NO4S2/c1-23-13-5-2-4-12(10-13)18-16(20)11-22-17(21)8-7-14(19)15-6-3-9-24-15/h2-6,9-10H,7-8,11H2,1H3,(H,18,20)