7-(furan-2-yl)-3-[[3-(pyridin-2-ylmethylamino)phenyl]methyl]-[1,2,3]triazolo[4,5-d]pyrimidin-5-amine

Systemtic Name: 7-(furan-2-yl)-3-[[3-(pyridin-2-ylmethylamino)phenyl]methyl]-[1,2,3]triazolo[4,5-d]pyrimidin-5-amine Openeye Name: 7-(2-furyl)-3-[[3-(2-pyridylmethylamino)phenyl]methyl]triazolo[4,5-d]pyrimidin-5-amine CAS Name: 7-(2-furanyl)-3-[[3-(2-pyridinylmethylamino)phenyl]methyl]-5-triazolo[4,5-d]pyrimidinamine IUPAC Name: 7-(furan-2-yl)-3-[[3-(pyridin-2-ylmethylamino)phenyl]methyl]triazolo[4,5-d]pyrimidin-5-amine Traditional Name: [3-[[5-amino-7-(2-furyl)triazolo[4,5-d]pyrimidin-3-yl]methyl]phenyl]-(2-pyridylmethyl)amine Formula: C21H18N8O MolecularWeight: 398.42062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC2=CC=CC(=C2)CN3C4=NC(=NC(=C4N=N3)C5=CC=CO5)N

Isomeric SMILES

C1=CC=NC(=C1)CNC2=CC=CC(=C2)CN3C4=NC(=NC(=C4N=N3)C5=CC=CO5)N

InChI

InChI=1S/C21H18N8O/c22-21-25-18(17-8-4-10-30-17)19-20(26-21)29(28-27-19)13-14-5-3-7-15(11-14)24-12-16-6-1-2-9-23-16/h1-11,24H,12-13H2,(H2,22,25,26)