sodium 3-(6-methyl-7H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)benzenesulfonate

Systemtic Name: sodium 3-(6-methyl-7H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)benzenesulfonate Openeye Name: sodium 3-(6-methyl-7H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)benzenesulfonate CAS Name: sodium 3-(6-methyl-7H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)benzenesulfonate IUPAC Name: sodium 3-(6-methyl-7H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)benzenesulfonate Traditional Name: sodium 3-(6-methyl-7H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)besylate Formula: C11H9N4NaO3S MolecularWeight: 300.26893

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=NC(=N2)C3=CC(=CC=C3)S(=O)(=O)[O-])C1.[Na+]

Isomeric SMILES

CC1=NN2C(=NC(=N2)C3=CC(=CC=C3)S(=O)(=O)[O-])C1.[Na+]

InChI

InChI=1S/C11H10N4O3S.Na/c1-7-5-10-12-11(14-15(10)13-7)8-3-2-4-9(6-8)19(16,17)18;/h2-4,6H,5H2,1H3,(H,16,17,18);/q;+1/p-1