2-[[4-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate

Systemtic Name: 2-[[4-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Openeye Name: 2-[[4-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate CAS Name: 2-[[[[4-methoxy-6-(trifluoromethyl)-2-pyrimidinyl]amino]-oxomethyl]sulfamoyl]benzoate IUPAC Name: 2-[[4-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Traditional Name: 2-[[4-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Formula: C14H10F3N4O6S- MolecularWeight: 419.31261

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)C(F)(F)F)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

COC1=NC(=NC(=C1)C(F)(F)F)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C14H11F3N4O6S/c1-27-10-6-9(14(15,16)17)18-12(19-10)20-13(24)21-28(25,26)8-5-3-2-4-7(8)11(22)23/h2-6H,1H3,(H,22,23)(H2,18,19,20,21,24)/p-1