N-[1-(3-bromophenyl)ethyl]-1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[1-(3-bromophenyl)ethyl]-1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[1-(3-bromophenyl)ethyl]-1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[1-(3-bromophenyl)ethyl]-1-(4-methylphenyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[1-(3-bromophenyl)ethyl]-1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-[1-(3-bromophenyl)ethyl]-1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C20H17BrF3N3O MolecularWeight: 452.26769

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC(C)C3=CC(=CC=C3)Br)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC(C)C3=CC(=CC=C3)Br)C(F)(F)F

InChI

InChI=1S/C20H17BrF3N3O/c1-12-6-8-16(9-7-12)27-18(20(22,23)24)17(11-25-27)19(28)26-13(2)14-4-3-5-15(21)10-14/h3-11,13H,1-2H3,(H,26,28)