dipotassium 2-[3-methyl-5-(methylsulfonylamino)pyrazol-1-yl]-4-oxidanidylperoxysulfanyl-benzenesulfinate

Systemtic Name: dipotassium 2-[3-methyl-5-(methylsulfonylamino)pyrazol-1-yl]-4-oxidanidylperoxysulfanyl-benzenesulfinate Openeye Name: dipotassium 2-[5-(methanesulfonamido)-3-methyl-pyrazol-1-yl]-4-oxidoperoxysulfanyl-benzenesulfinate CAS Name: dipotassium 2-[5-(methanesulfonamido)-3-methyl-1-pyrazolyl]-4-(oxidodioxythio)benzenesulfinate IUPAC Name: dipotassium 2-[5-(methanesulfonamido)-3-methylpyrazol-1-yl]-4-oxidoperoxysulfanylbenzenesulfinate Traditional Name: dipotassium 2-[5-(methanesulfonamido)-3-methyl-pyrazol-1-yl]-4-(oxidoperoxythio)benzenesulfinate Formula: C11H11K2N3O7S3 MolecularWeight: 471.61254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O7S3.2K/c1-7-5-11(13-24(2,18)19)14(12-7)9-6-8(22-21-20-15)3-4-10(9)23(16)17;;/h3-6,13,15H,1-2H3,(H,16,17);;/q;2*+1/p-2