2-ethyl-4-(4-fluorophenyl)-4-(3-methylsulfonylphenyl)-3-(trifluoromethyl)-3H-pyrazole

Systemtic Name: 2-ethyl-4-(4-fluorophenyl)-4-(3-methylsulfonylphenyl)-3-(trifluoromethyl)-3H-pyrazole Openeye Name: 2-ethyl-4-(4-fluorophenyl)-4-(3-methylsulfonylphenyl)-3-(trifluoromethyl)-3H-pyrazole CAS Name: 2-ethyl-4-(4-fluorophenyl)-4-(3-methylsulfonylphenyl)-3-(trifluoromethyl)-3H-pyrazole IUPAC Name: 2-ethyl-4-(4-fluorophenyl)-4-(3-methylsulfonylphenyl)-3-(trifluoromethyl)-3H-pyrazole Traditional Name: 1-ethyl-4-(4-fluorophenyl)-4-(3-mesylphenyl)-5-(trifluoromethyl)-2-pyrazoline Formula: C19H18F4N2O2S MolecularWeight: 414.417033

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18F4N2O2S/c1-3-25-17(19(21,22)23)18(12-24-25,13-7-9-15(20)10-8-13)14-5-4-6-16(11-14)28(2,26)27/h4-12,17H,3H2,1-2H3