4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-3-phenoxy-1-prop-2-enyl-pyrazole

Systemtic Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-3-phenoxy-1-prop-2-enyl-pyrazole Openeye Name: 1-allyl-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-3-phenoxy-pyrazole CAS Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-3-phenoxy-1-prop-2-enylpyrazole IUPAC Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-3-phenoxy-1-prop-2-enylpyrazole Traditional Name: 1-allyl-4-(4-fluorophenyl)-5-(4-mesylphenyl)-3-phenoxy-pyrazole Formula: C25H21FN2O3S MolecularWeight: 448.509243

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NN2CC=C)OC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NN2CC=C)OC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H21FN2O3S/c1-3-17-28-24(19-11-15-22(16-12-19)32(2,29)30)23(18-9-13-20(26)14-10-18)25(27-28)31-21-7-5-4-6-8-21/h3-16H,1,17H2,2H3