(4-chloranyl-2-methyl-phenyl) 1-(dimethylsulfamoyl)-1,2,4-triazole-3-sulfonate

Systemtic Name: (4-chloranyl-2-methyl-phenyl) 1-(dimethylsulfamoyl)-1,2,4-triazole-3-sulfonate Openeye Name: (4-chloro-2-methyl-phenyl) 1-(dimethylsulfamoyl)-1,2,4-triazole-3-sulfonate CAS Name: 1-(dimethylsulfamoyl)-1,2,4-triazole-3-sulfonic acid (4-chloro-2-methylphenyl) ester IUPAC Name: (4-chloro-2-methylphenyl) 1-(dimethylsulfamoyl)-1,2,4-triazole-3-sulfonate Traditional Name: 1-(dimethylsulfamoyl)-1,2,4-triazole-3-sulfonic acid (4-chloro-2-methyl-phenyl) ester Formula: C11H13ClN4O5S2 MolecularWeight: 380.82772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OS(=O)(=O)C2=NN(C=N2)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OS(=O)(=O)C2=NN(C=N2)S(=O)(=O)N(C)C

InChI

InChI=1S/C11H13ClN4O5S2/c1-8-6-9(12)4-5-10(8)21-22(17,18)11-13-7-16(14-11)23(19,20)15(2)3/h4-7H,1-3H3