[1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 4-[(3-fluoranyl-2-methyl-phenyl)sulfonylamino]benzoate

Systemtic Name: [1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 4-[(3-fluoranyl-2-methyl-phenyl)sulfonylamino]benzoate Openeye Name: [2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 4-[(3-fluoro-2-methyl-phenyl)sulfonylamino]benzoate CAS Name: 4-[(3-fluoro-2-methylphenyl)sulfonylamino]benzoic acid [1-oxo-1-[[oxo-(propan-2-ylamino)methyl]amino]propan-2-yl] ester IUPAC Name: [1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 4-[(3-fluoro-2-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[(3-fluoro-2-methyl-phenyl)sulfonylamino]benzoic acid [2-(isopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H24FN3O6S MolecularWeight: 465.495163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)NC2=CC=C(C=C2)C(=O)OC(C)C(=O)NC(=O)NC(C)C)F

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)NC2=CC=C(C=C2)C(=O)OC(C)C(=O)NC(=O)NC(C)C)F

InChI

InChI=1S/C21H24FN3O6S/c1-12(2)23-21(28)24-19(26)14(4)31-20(27)15-8-10-16(11-9-15)25-32(29,30)18-7-5-6-17(22)13(18)3/h5-12,14,25H,1-4H3,(H2,23,24,26,28)