5-methyl-2-(2-oxidanylsulfonothioylphenyl)-4H-pyrazol-3-one

Systemtic Name: 5-methyl-2-(2-oxidanylsulfonothioylphenyl)-4H-pyrazol-3-one Openeye Name: 2-(2-hydroxysulfonothioylphenyl)-5-methyl-4H-pyrazol-3-one CAS Name: 2-(2-hydroxysulfonothioylphenyl)-5-methyl-4H-pyrazol-3-one IUPAC Name: 2-(2-hydroxysulfonothioylphenyl)-5-methyl-4H-pyrazol-3-one Traditional Name: 2-(2-hydroxysulfonothioylphenyl)-5-methyl-2-pyrazolin-3-one Formula: C10H10N2O3S2 MolecularWeight: 270.328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C2=CC=CC=C2S(=O)(=S)O

Isomeric SMILES

CC1=NN(C(=O)C1)C2=CC=CC=C2S(=O)(=S)O

InChI

InChI=1S/C10H10N2O3S2/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)