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

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate Openeye Name: (2-oxo-2-ureido-ethyl) 3-(4-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(4-fluorophenyl)thio]propanoic acid [2-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-2-oxoethyl] 3-(4-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-fluorophenyl)thio]propionic acid (2-keto-2-ureido-ethyl) ester Formula: C12H13FN2O4S MolecularWeight: 300.306023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1F)SCCC(=O)OCC(=O)NC(=O)N

Isomeric SMILES

C1=CC(=CC=C1F)SCCC(=O)OCC(=O)NC(=O)N

InChI

InChI=1S/C12H13FN2O4S/c13-8-1-3-9(4-2-8)20-6-5-11(17)19-7-10(16)15-12(14)18/h1-4H,5-7H2,(H3,14,15,16,18)