4-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)aniline

Systemtic Name: 4-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)aniline Openeye Name: 4-[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]aniline CAS Name: 4-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)aniline IUPAC Name: 4-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)aniline Traditional Name: [4-[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]phenyl]amine Formula: C13H11N5 MolecularWeight: 237.25994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NNC(=N2)C3=CC=NC=C3)N

Isomeric SMILES

C1=CC(=CC=C1C2=NNC(=N2)C3=CC=NC=C3)N

InChI

InChI=1S/C13H11N5/c14-11-3-1-9(2-4-11)12-16-13(18-17-12)10-5-7-15-8-6-10/h1-8H,14H2,(H,16,17,18)