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

Systemtic Name: methyl 2-[[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate CAS Name: 2-[[oxo-[[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]amino]methyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Traditional Name: 2-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid methyl ester Formula: C18H13F3N4O5S2 MolecularWeight: 486.44483

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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=CS3

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3

InChI

InChI=1S/C18H13F3N4O5S2/c1-30-15(26)10-5-2-3-7-13(10)32(28,29)25-17(27)24-16-22-11(12-6-4-8-31-12)9-14(23-16)18(19,20)21/h2-9H,1H3,(H2,22,23,24,25,27)