N-[3-oxidanylidene-2-[[2-(trioxidanylsulfanyl)phenyl]methyl]-1H-pyrazol-5-yl]methanesulfonamide

Systemtic Name: N-[3-oxidanylidene-2-[[2-(trioxidanylsulfanyl)phenyl]methyl]-1H-pyrazol-5-yl]methanesulfonamide Openeye Name: N-[3-oxo-2-[[2-(trioxidanylsulfanyl)phenyl]methyl]-1H-pyrazol-5-yl]methanesulfonamide CAS Name: 2-[[5-(methanesulfonamido)-3-oxo-1H-pyrazol-2-yl]methyl]benzenesulfenic acid hydroperoxy ester IUPAC Name: N-[3-oxo-2-[[2-(trioxidanylsulfanyl)phenyl]methyl]-1H-pyrazol-5-yl]methanesulfonamide Traditional Name: N-[5-keto-1-[2-(trioxidanylthio)benzyl]-3-pyrazolin-3-yl]methanesulfonamide Formula: C11H13N3O6S2 MolecularWeight: 347.36742

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC(=O)N(N1)CC2=CC=CC=C2SOOO

Isomeric SMILES

CS(=O)(=O)NC1=CC(=O)N(N1)CC2=CC=CC=C2SOOO

InChI

InChI=1S/C11H13N3O6S2/c1-22(17,18)13-10-6-11(15)14(12-10)7-8-4-2-3-5-9(8)21-20-19-16/h2-6,12-13,16H,7H2,1H3