[2-[[4-methoxy-6-(trifluoromethyloxy)pyrimidin-2-yl]carbamoylsulfamoyl]phenyl]methanesulfonate

Systemtic Name: [2-[[4-methoxy-6-(trifluoromethyloxy)pyrimidin-2-yl]carbamoylsulfamoyl]phenyl]methanesulfonate Openeye Name: [2-[[4-methoxy-6-(trifluoromethoxy)pyrimidin-2-yl]carbamoylsulfamoyl]phenyl]methanesulfonate CAS Name: [2-[[[[4-methoxy-6-(trifluoromethoxy)-2-pyrimidinyl]amino]-oxomethyl]sulfamoyl]phenyl]methanesulfonate IUPAC Name: [2-[[4-methoxy-6-(trifluoromethoxy)pyrimidin-2-yl]carbamoylsulfamoyl]phenyl]methanesulfonate Traditional Name: [2-[[4-methoxy-6-(trifluoromethoxy)pyrimidin-2-yl]carbamoylsulfamoyl]phenyl]methanesulfonate Formula: C14H12F3N4O8S2- MolecularWeight: 485.39229

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2CS(=O)(=O)[O-])OC(F)(F)F

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2CS(=O)(=O)[O-])OC(F)(F)F

InChI

InChI=1S/C14H13F3N4O8S2/c1-28-10-6-11(29-14(15,16)17)19-12(18-10)20-13(22)21-31(26,27)9-5-3-2-4-8(9)7-30(23,24)25/h2-6H,7H2,1H3,(H,23,24,25)(H2,18,19,20,21,22)/p-1