[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(4-fluorophenyl)thio]propanoic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] 3-(4-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-fluorophenyl)thio]propionic acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C13H15FN2O4S MolecularWeight: 314.332603

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)COC(=O)CCSC1=CC=C(C=C1)F

Isomeric SMILES

CNC(=O)NC(=O)COC(=O)CCSC1=CC=C(C=C1)F

InChI

InChI=1S/C13H15FN2O4S/c1-15-13(19)16-11(17)8-20-12(18)6-7-21-10-4-2-9(14)3-5-10/h2-5H,6-8H2,1H3,(H2,15,16,17,19)