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

Systemtic Name: methyl 2-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate CAS Name: 2-[[oxo-[[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]amino]methyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Traditional Name: 2-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid methyl ester Formula: C20H15F3N4O5S MolecularWeight: 480.41711

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C20H15F3N4O5S/c1-32-17(28)13-9-5-6-10-15(13)33(30,31)27-19(29)26-18-24-14(12-7-3-2-4-8-12)11-16(25-18)20(21,22)23/h2-11H,1H3,(H2,24,25,26,27,29)