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

Systemtic Name: 2-[1-(1H-indazol-5-yl)-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)aniline Openeye Name: 2-[1-(1H-indazol-5-yl)-1,2,4-triazol-3-yl]-N-(4-pyridylmethyl)aniline CAS Name: 2-[1-(1H-indazol-5-yl)-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)aniline IUPAC Name: 2-[1-(1H-indazol-5-yl)-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)aniline Traditional Name: [2-[1-(1H-indazol-5-yl)-1,2,4-triazol-3-yl]phenyl]-(4-pyridylmethyl)amine Formula: C21H17N7 MolecularWeight: 367.40658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NN(C=N2)C3=CC4=C(C=C3)NN=C4)NCC5=CC=NC=C5

Isomeric SMILES

C1=CC=C(C(=C1)C2=NN(C=N2)C3=CC4=C(C=C3)NN=C4)NCC5=CC=NC=C5

InChI

InChI=1S/C21H17N7/c1-2-4-20(23-12-15-7-9-22-10-8-15)18(3-1)21-24-14-28(27-21)17-5-6-19-16(11-17)13-25-26-19/h1-11,13-14,23H,12H2,(H,25,26)