1-(4-bromophenyl)-3-phenyl-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazole

Systemtic Name: 1-(4-bromophenyl)-3-phenyl-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazole Openeye Name: 1-(4-bromophenyl)-3-phenyl-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazole CAS Name: 1-(4-bromophenyl)-3-phenyl-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazole IUPAC Name: 1-(4-bromophenyl)-3-phenyl-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazole Traditional Name: 1-(4-bromophenyl)-3-phenyl-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazole Formula: C21H13BrF3N3 MolecularWeight: 444.24723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=N2)C3=CC=C(C=C3)C(F)(F)F)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=N2)C3=CC=C(C=C3)C(F)(F)F)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H13BrF3N3/c22-17-10-12-18(13-11-17)28-20(15-6-8-16(9-7-15)21(23,24)25)26-19(27-28)14-4-2-1-3-5-14/h1-13H