methyl 2-[[4-fluoranyl-6-(trifluoromethyloxy)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 2-[[4-fluoranyl-6-(trifluoromethyloxy)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[[4-fluoro-6-(trifluoromethoxy)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate CAS Name: 2-[[[[4-fluoro-6-(trifluoromethoxy)-2-pyrimidinyl]amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-fluoro-6-(trifluoromethoxy)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Traditional Name: 2-[[4-fluoro-6-(trifluoromethoxy)pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid methyl ester Formula: C14H10F4N4O6S MolecularWeight: 438.311013

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)F)OC(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)F)OC(F)(F)F

InChI

InChI=1S/C14H10F4N4O6S/c1-27-11(23)7-4-2-3-5-8(7)29(25,26)22-13(24)21-12-19-9(15)6-10(20-12)28-14(16,17)18/h2-6H,1H3,(H2,19,20,21,22,24)