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

Systemtic Name: methyl 2-[(6-methyl-4-oxidanylidene-1H-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[(6-methyl-4-oxo-1H-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate CAS Name: 2-[[[(6-methyl-4-oxo-1H-1,3,5-triazin-2-yl)amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(6-methyl-4-oxo-1H-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate Traditional Name: 2-[(4-keto-6-methyl-1H-s-triazin-2-yl)carbamoylsulfamoyl]benzoic acid methyl ester Formula: C13H13N5O6S MolecularWeight: 367.33722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)N=C(N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC

Isomeric SMILES

CC1=NC(=O)N=C(N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C13H13N5O6S/c1-7-14-11(16-12(20)15-7)17-13(21)18-25(22,23)9-6-4-3-5-8(9)10(19)24-2/h3-6H,1-2H3,(H3,14,15,16,17,18,20,21)