sodium 5-methyl-2-(2-oxidanidylsulfonothioylphenyl)-4H-pyrazol-3-one

Systemtic Name: sodium 5-methyl-2-(2-oxidanidylsulfonothioylphenyl)-4H-pyrazol-3-one Openeye Name: sodium 5-methyl-2-(2-oxidosulfonothioylphenyl)-4H-pyrazol-3-one CAS Name: sodium 5-methyl-2-(2-oxidosulfonothioylphenyl)-4H-pyrazol-3-one IUPAC Name: sodium 5-methyl-2-(2-oxidosulfonothioylphenyl)-4H-pyrazol-3-one Traditional Name: sodium 5-methyl-2-(2-oxidosulfonothioylphenyl)-2-pyrazolin-3-one Formula: C10H9N2NaO3S2 MolecularWeight: 292.30983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C2=CC=CC=C2S(=O)(=S)[O-].[Na+]

Isomeric SMILES

CC1=NN(C(=O)C1)C2=CC=CC=C2S(=O)(=S)[O-].[Na+]

InChI

InChI=1S/C10H10N2O3S2.Na/c1-7-6-10(13)12(11-7)8-4-2-3-5-9(8)17(14,15)16;/h2-5H,6H2,1H3,(H,14,15,16);/q;+1/p-1