methyl 2-[[4-ethoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 2-[[4-ethoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[[4-ethoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate CAS Name: 2-[[[[4-ethoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-ethoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate Traditional Name: 2-[[4-ethoxy-6-(trifluoromethyl)-s-triazin-2-yl]carbamoylsulfamoyl]benzoic acid methyl ester Formula: C15H14F3N5O6S MolecularWeight: 449.36177

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)C(F)(F)F

Isomeric SMILES

CCOC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)C(F)(F)F

InChI

InChI=1S/C15H14F3N5O6S/c1-3-29-14-20-11(15(16,17)18)19-12(22-14)21-13(25)23-30(26,27)9-7-5-4-6-8(9)10(24)28-2/h4-7H,3H2,1-2H3,(H2,19,20,21,22,23,25)