[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-[3-(trifluoromethyl)phenyl]sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-[3-(trifluoromethyl)phenyl]sulfanylethanoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-[3-(trifluoromethyl)phenyl]sulfanylacetate CAS Name: 2-[[3-(trifluoromethyl)phenyl]thio]acetic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-[3-(trifluoromethyl)phenyl]sulfanylacetate Traditional Name: 2-[[3-(trifluoromethyl)phenyl]thio]acetic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C15H17F3N2O4S MolecularWeight: 378.36669

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)CSC1=CC=CC(=C1)C(F)(F)F

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)CSC1=CC=CC(=C1)C(F)(F)F

InChI

InChI=1S/C15H17F3N2O4S/c1-2-6-19-14(23)20-12(21)8-24-13(22)9-25-11-5-3-4-10(7-11)15(16,17)18/h3-5,7H,2,6,8-9H2,1H3,(H2,19,20,21,23)