[1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 2-[(4-fluorophenyl)sulfonylamino]benzoate

Systemtic Name: [1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 2-[(4-fluorophenyl)sulfonylamino]benzoate Openeye Name: [2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 2-[(4-fluorophenyl)sulfonylamino]benzoate CAS Name: 2-[(4-fluorophenyl)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] 2-[(4-fluorophenyl)sulfonylamino]benzoate Traditional Name: 2-[(4-fluorophenyl)sulfonylamino]benzoic acid [2-(isopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H22FN3O6S MolecularWeight: 451.468583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)OC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)NC(=O)NC(=O)C(C)OC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C20H22FN3O6S/c1-12(2)22-20(27)23-18(25)13(3)30-19(26)16-6-4-5-7-17(16)24-31(28,29)15-10-8-14(21)9-11-15/h4-13,24H,1-3H3,(H2,22,23,25,27)