2-[1-(4-bromophenyl)-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)aniline

Systemtic Name: 2-[1-(4-bromophenyl)-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)aniline Openeye Name: 2-[1-(4-bromophenyl)-1,2,4-triazol-3-yl]-N-(4-pyridylmethyl)aniline CAS Name: 2-[1-(4-bromophenyl)-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)aniline IUPAC Name: 2-[1-(4-bromophenyl)-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)aniline Traditional Name: [2-[1-(4-bromophenyl)-1,2,4-triazol-3-yl]phenyl]-(4-pyridylmethyl)amine Formula: C20H16BrN5 MolecularWeight: 406.27854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NN(C=N2)C3=CC=C(C=C3)Br)NCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C(=C1)C2=NN(C=N2)C3=CC=C(C=C3)Br)NCC4=CC=NC=C4

InChI

InChI=1S/C20H16BrN5/c21-16-5-7-17(8-6-16)26-14-24-20(25-26)18-3-1-2-4-19(18)23-13-15-9-11-22-12-10-15/h1-12,14,23H,13H2