2-[3-(4-phenoxyphenyl)-1H-1,2,4-triazol-5-yl]-N-(pyridin-4-ylmethyl)aniline

Systemtic Name: 2-[3-(4-phenoxyphenyl)-1H-1,2,4-triazol-5-yl]-N-(pyridin-4-ylmethyl)aniline Openeye Name: 2-[3-(4-phenoxyphenyl)-1H-1,2,4-triazol-5-yl]-N-(4-pyridylmethyl)aniline CAS Name: 2-[3-(4-phenoxyphenyl)-1H-1,2,4-triazol-5-yl]-N-(pyridin-4-ylmethyl)aniline IUPAC Name: 2-[3-(4-phenoxyphenyl)-1H-1,2,4-triazol-5-yl]-N-(pyridin-4-ylmethyl)aniline Traditional Name: [2-[3-(4-phenoxyphenyl)-1H-1,2,4-triazol-5-yl]phenyl]-(4-pyridylmethyl)amine Formula: C26H21N5O MolecularWeight: 419.47784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=NNC(=N3)C4=CC=CC=C4NCC5=CC=NC=C5

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=NNC(=N3)C4=CC=CC=C4NCC5=CC=NC=C5

InChI

InChI=1S/C26H21N5O/c1-2-6-21(7-3-1)32-22-12-10-20(11-13-22)25-29-26(31-30-25)23-8-4-5-9-24(23)28-18-19-14-16-27-17-15-19/h1-17,28H,18H2,(H,29,30,31)