2-phenyl-5-(phenylsulfonylmethyl)-1H-pyrazol-3-one

Systemtic Name: 2-phenyl-5-(phenylsulfonylmethyl)-1H-pyrazol-3-one Openeye Name: 5-(benzenesulfonylmethyl)-2-phenyl-1H-pyrazol-3-one CAS Name: 5-(benzenesulfonylmethyl)-2-phenyl-1H-pyrazol-3-one IUPAC Name: 5-(benzenesulfonylmethyl)-2-phenyl-1H-pyrazol-3-one Traditional Name: 5-(besylmethyl)-2-phenyl-3-pyrazolin-3-one Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C=C(N2)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C=C(N2)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O3S/c19-16-11-13(17-18(16)14-7-3-1-4-8-14)12-22(20,21)15-9-5-2-6-10-15/h1-11,17H,12H2