3-[bis(fluoranyl)methyl]-4-(4-iodophenyl)-5-(4-methylsulfonylphenyl)-1-phenyl-pyrazole

Systemtic Name: 3-[bis(fluoranyl)methyl]-4-(4-iodophenyl)-5-(4-methylsulfonylphenyl)-1-phenyl-pyrazole Openeye Name: 3-(difluoromethyl)-4-(4-iodophenyl)-5-(4-methylsulfonylphenyl)-1-phenyl-pyrazole CAS Name: 3-(difluoromethyl)-4-(4-iodophenyl)-5-(4-methylsulfonylphenyl)-1-phenylpyrazole IUPAC Name: 3-(difluoromethyl)-4-(4-iodophenyl)-5-(4-methylsulfonylphenyl)-1-phenylpyrazole Traditional Name: 3-(difluoromethyl)-4-(4-iodophenyl)-5-(4-mesylphenyl)-1-phenyl-pyrazole Formula: C23H17F2IN2O2S MolecularWeight: 550.359556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3)C(F)F)C4=CC=C(C=C4)I

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3)C(F)F)C4=CC=C(C=C4)I

InChI

InChI=1S/C23H17F2IN2O2S/c1-31(29,30)19-13-9-16(10-14-19)22-20(15-7-11-17(26)12-8-15)21(23(24)25)27-28(22)18-5-3-2-4-6-18/h2-14,23H,1H3