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

Systemtic Name: N-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazole-1-carboxamide Openeye Name: N-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazole-1-carboxamide CAS Name: N-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-1-pyrazolecarboxamide IUPAC Name: N-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazole-1-carboxamide Traditional Name: N-ethyl-4-(4-fluorophenyl)-3-(4-mesylphenyl)-5-(trifluoromethyl)pyrazole-1-carboxamide Formula: C20H17F4N3O3S MolecularWeight: 455.425893

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1C(=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F)C(F)(F)F

Isomeric SMILES

CCNC(=O)N1C(=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/C20H17F4N3O3S/c1-3-25-19(28)27-18(20(22,23)24)16(12-4-8-14(21)9-5-12)17(26-27)13-6-10-15(11-7-13)31(2,29)30/h4-11H,3H2,1-2H3,(H,25,28)