[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 4-(4-methylsulfanylphenyl)-4-oxo-butanoate CAS Name: 4-[4-(methylthio)phenyl]-4-oxobutanoic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 4-(4-methylsulfanylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-[4-(methylthio)phenyl]butyric acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)CCC(=O)C1=CC=C(C=C1)SC

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)CCC(=O)C1=CC=C(C=C1)SC

InChI

InChI=1S/C17H22N2O5S/c1-3-10-18-17(23)19-15(21)11-24-16(22)9-8-14(20)12-4-6-13(25-2)7-5-12/h4-7H,3,8-11H2,1-2H3,(H2,18,19,21,23)