N-(4-bromophenyl)-5-[1-(3-fluoranyl-4-phenyl-phenyl)ethyl]-1H-1,2,4-triazol-3-amine

Systemtic Name: N-(4-bromophenyl)-5-[1-(3-fluoranyl-4-phenyl-phenyl)ethyl]-1H-1,2,4-triazol-3-amine Openeye Name: N-(4-bromophenyl)-5-[1-(3-fluoro-4-phenyl-phenyl)ethyl]-1H-1,2,4-triazol-3-amine CAS Name: N-(4-bromophenyl)-5-[1-(3-fluoro-4-phenylphenyl)ethyl]-1H-1,2,4-triazol-3-amine IUPAC Name: N-(4-bromophenyl)-5-[1-(3-fluoro-4-phenylphenyl)ethyl]-1H-1,2,4-triazol-3-amine Traditional Name: (4-bromophenyl)-[5-[1-(3-fluoro-4-phenyl-phenyl)ethyl]-1H-1,2,4-triazol-3-yl]amine Formula: C22H18BrFN4 MolecularWeight: 437.307523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C3=NC(=NN3)NC4=CC=C(C=C4)Br

Isomeric SMILES

CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C3=NC(=NN3)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H18BrFN4/c1-14(16-7-12-19(20(24)13-16)15-5-3-2-4-6-15)21-26-22(28-27-21)25-18-10-8-17(23)9-11-18/h2-14H,1H3,(H2,25,26,27,28)