4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,2-dihydropyrazol-3-one

Systemtic Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,2-dihydropyrazol-3-one Openeye Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,2-dihydropyrazol-3-one CAS Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,2-dihydropyrazol-3-one Traditional Name: 4-(4-fluorophenyl)-5-(4-mesylphenyl)-3-pyrazolin-3-one Formula: C16H13FN2O3S MolecularWeight: 332.349423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)NN2)C3=CC=C(C=C3)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)NN2)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H13FN2O3S/c1-23(21,22)13-8-4-11(5-9-13)15-14(16(20)19-18-15)10-2-6-12(17)7-3-10/h2-9H,1H3,(H2,18,19,20)