disodium 2-(5-azanyl-3-methyl-pyrazol-1-yl)-4-oxidanidylperoxysulfanyl-benzenesulfonate

Systemtic Name: disodium 2-(5-azanyl-3-methyl-pyrazol-1-yl)-4-oxidanidylperoxysulfanyl-benzenesulfonate Openeye Name: disodium 2-(5-amino-3-methyl-pyrazol-1-yl)-4-oxidoperoxysulfanyl-benzenesulfonate CAS Name: disodium 2-(5-amino-3-methyl-1-pyrazolyl)-4-(oxidodioxythio)benzenesulfonate IUPAC Name: disodium 2-(5-amino-3-methylpyrazol-1-yl)-4-oxidoperoxysulfanylbenzenesulfonate Traditional Name: disodium 2-(5-amino-3-methyl-pyrazol-1-yl)-4-(oxidoperoxythio)besylate Formula: C10H9N3Na2O6S2 MolecularWeight: 377.3045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)N)C2=C(C=CC(=C2)SOO[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=NN(C(=C1)N)C2=C(C=CC(=C2)SOO[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C10H11N3O6S2.2Na/c1-6-4-10(11)13(12-6)8-5-7(20-19-18-14)2-3-9(8)21(15,16)17;;/h2-5,14H,11H2,1H3,(H,15,16,17);;/q;2*+1/p-2