2-ethyl-4-(3-fluoranyl-4-methyl-phenyl)-4-(3-methylsulfonylphenyl)-3-(trifluoromethyl)-3H-pyrazole

Systemtic Name: 2-ethyl-4-(3-fluoranyl-4-methyl-phenyl)-4-(3-methylsulfonylphenyl)-3-(trifluoromethyl)-3H-pyrazole Openeye Name: 2-ethyl-4-(3-fluoro-4-methyl-phenyl)-4-(3-methylsulfonylphenyl)-3-(trifluoromethyl)-3H-pyrazole CAS Name: 2-ethyl-4-(3-fluoro-4-methylphenyl)-4-(3-methylsulfonylphenyl)-3-(trifluoromethyl)-3H-pyrazole IUPAC Name: 2-ethyl-4-(3-fluoro-4-methylphenyl)-4-(3-methylsulfonylphenyl)-3-(trifluoromethyl)-3H-pyrazole Traditional Name: 1-ethyl-4-(3-fluoro-4-methyl-phenyl)-4-(3-mesylphenyl)-5-(trifluoromethyl)-2-pyrazoline Formula: C20H20F4N2O2S MolecularWeight: 428.443613

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C(C=N1)(C2=CC(=CC=C2)S(=O)(=O)C)C3=CC(=C(C=C3)C)F)C(F)(F)F

Isomeric SMILES

CCN1C(C(C=N1)(C2=CC(=CC=C2)S(=O)(=O)C)C3=CC(=C(C=C3)C)F)C(F)(F)F

InChI

InChI=1S/C20H20F4N2O2S/c1-4-26-18(20(22,23)24)19(12-25-26,15-9-8-13(2)17(21)11-15)14-6-5-7-16(10-14)29(3,27)28/h5-12,18H,4H2,1-3H3