methyl 2-[[4-[bis(fluoranyl)methoxy]pyrimidin-2-yl]carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 2-[[4-[bis(fluoranyl)methoxy]pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[[4-(difluoromethoxy)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate CAS Name: 2-[[[[4-(difluoromethoxy)-2-pyrimidinyl]amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-(difluoromethoxy)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Traditional Name: 2-[[4-(difluoromethoxy)pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid methyl ester Formula: C14H12F2N4O6S MolecularWeight: 402.330086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12F2N4O6S/c1-25-11(21)8-4-2-3-5-9(8)27(23,24)20-14(22)19-13-17-7-6-10(18-13)26-12(15)16/h2-7,12H,1H3,(H2,17,18,19,20,22)