[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(3-fluorophenyl)-2-imidazolyl]thio]acetic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(3-fluorophenyl)imidazol-2-yl]thio]acetic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H19FN4O4S MolecularWeight: 394.420563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)CSC1=NC=CN1C2=CC(=CC=C2)F

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC(=O)CSC1=NC=CN1C2=CC(=CC=C2)F

InChI

InChI=1S/C17H19FN4O4S/c1-11(2)20-16(25)21-14(23)9-26-15(24)10-27-17-19-6-7-22(17)13-5-3-4-12(18)8-13/h3-8,11H,9-10H2,1-2H3,(H2,20,21,23,25)