2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzenesulfonic acid

Systemtic Name: 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzenesulfonic acid Openeye Name: 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzenesulfonic acid CAS Name: 2-[[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]-oxomethyl]sulfamoyl]benzenesulfonic acid IUPAC Name: 2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzenesulfonic acid Traditional Name: 2-[(4-methoxy-6-methyl-s-triazin-2-yl)carbamoylsulfamoyl]besylic acid Formula: C12H13N5O7S2 MolecularWeight: 403.39092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2S(=O)(=O)O

InChI

InChI=1S/C12H13N5O7S2/c1-7-13-10(16-12(14-7)24-2)15-11(18)17-25(19,20)8-5-3-4-6-9(8)26(21,22)23/h3-6H,1-2H3,(H,21,22,23)(H2,13,14,15,16,17,18)