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

Systemtic Name: 3-[bis(fluoranyl)methyl]-4-(4-ethylphenyl)-5-(4-methylsulfonylphenyl)-1-phenyl-pyrazole Openeye Name: 3-(difluoromethyl)-4-(4-ethylphenyl)-5-(4-methylsulfonylphenyl)-1-phenyl-pyrazole CAS Name: 3-(difluoromethyl)-4-(4-ethylphenyl)-5-(4-methylsulfonylphenyl)-1-phenylpyrazole IUPAC Name: 3-(difluoromethyl)-4-(4-ethylphenyl)-5-(4-methylsulfonylphenyl)-1-phenylpyrazole Traditional Name: 3-(difluoromethyl)-4-(4-ethylphenyl)-5-(4-mesylphenyl)-1-phenyl-pyrazole Formula: C25H22F2N2O2S MolecularWeight: 452.516186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(N(N=C2C(F)F)C3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(N(N=C2C(F)F)C3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C25H22F2N2O2S/c1-3-17-9-11-18(12-10-17)22-23(25(26)27)28-29(20-7-5-4-6-8-20)24(22)19-13-15-21(16-14-19)32(2,30)31/h4-16,25H,3H2,1-2H3