4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-1-prop-1-ynyl-5-(trifluoromethyl)pyrazole

Systemtic Name: 4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-1-prop-1-ynyl-5-(trifluoromethyl)pyrazole Openeye Name: 4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-1-prop-1-ynyl-5-(trifluoromethyl)pyrazole CAS Name: 4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-1-prop-1-ynyl-5-(trifluoromethyl)pyrazole IUPAC Name: 4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-1-prop-1-ynyl-5-(trifluoromethyl)pyrazole Traditional Name: 4-(4-fluorophenyl)-3-(4-mesylphenyl)-1-prop-1-ynyl-5-(trifluoromethyl)pyrazole Formula: C20H14F4N2O2S MolecularWeight: 422.395973

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Descriptors Computed from Structure

Canonical SMILES:

CC#CN1C(=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F)C(F)(F)F

Isomeric SMILES

CC#CN1C(=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/C20H14F4N2O2S/c1-3-12-26-19(20(22,23)24)17(13-4-8-15(21)9-5-13)18(25-26)14-6-10-16(11-7-14)29(2,27)28/h4-11H,1-2H3