4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,2-bis(prop-2-enyl)pyrazol-3-one

Systemtic Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,2-bis(prop-2-enyl)pyrazol-3-one Openeye Name: 1,2-diallyl-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyrazol-3-one CAS Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,2-bis(prop-2-enyl)-3-pyrazolone IUPAC Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,2-bis(prop-2-enyl)pyrazol-3-one Traditional Name: 1,2-diallyl-4-(4-fluorophenyl)-5-(4-mesylphenyl)-3-pyrazolin-3-one Formula: C22H21FN2O3S MolecularWeight: 412.477143

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N2CC=C)CC=C)C3=CC=C(C=C3)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N2CC=C)CC=C)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FN2O3S/c1-4-14-24-21(17-8-12-19(13-9-17)29(3,27)28)20(22(26)25(24)15-5-2)16-6-10-18(23)11-7-16/h4-13H,1-2,14-15H2,3H3