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

Systemtic Name: 2-methyl-5-(4-methylsulfonylphenyl)-4H-pyrazol-3-one Openeye Name: 2-methyl-5-(4-methylsulfonylphenyl)-4H-pyrazol-3-one CAS Name: 2-methyl-5-(4-methylsulfonylphenyl)-4H-pyrazol-3-one IUPAC Name: 2-methyl-5-(4-methylsulfonylphenyl)-4H-pyrazol-3-one Traditional Name: 5-(4-mesylphenyl)-2-methyl-2-pyrazolin-3-one Formula: C11H12N2O3S MolecularWeight: 252.28958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC(=N1)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CN1C(=O)CC(=N1)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C11H12N2O3S/c1-13-11(14)7-10(12-13)8-3-5-9(6-4-8)17(2,15)16/h3-6H,7H2,1-2H3