1-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazole

Systemtic Name: 1-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazole Openeye Name: 1-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazole CAS Name: 1-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazole IUPAC Name: 1-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazole Traditional Name: 1-ethyl-4-(4-fluorophenyl)-3-(4-mesylphenyl)-5-(trifluoromethyl)pyrazole Formula: C19H16F4N2O2S MolecularWeight: 412.401153

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16F4N2O2S/c1-3-25-18(19(21,22)23)16(12-4-8-14(20)9-5-12)17(24-25)13-6-10-15(11-7-13)28(2,26)27/h4-11H,3H2,1-2H3