N4,N7,3-tris(phenylmethyl)imidazo[4,5-d]pyridazine-4,7-diamine

Systemtic Name: N4,N7,3-tris(phenylmethyl)imidazo[4,5-d]pyridazine-4,7-diamine Openeye Name: N4,N7,3-tribenzylimidazo[4,5-d]pyridazine-4,7-diamine CAS Name: N4,N7,3-tris(phenylmethyl)imidazo[4,5-d]pyridazine-4,7-diamine IUPAC Name: 4-N,7-N,3-tribenzylimidazo[4,5-d]pyridazine-4,7-diamine Traditional Name: benzyl-[3-benzyl-4-(benzylamino)imidazo[4,5-d]pyridazin-7-yl]amine Formula: C26H24N6 MolecularWeight: 420.50896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NN=C(C3=C2N=CN3CC4=CC=CC=C4)NCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NN=C(C3=C2N=CN3CC4=CC=CC=C4)NCC5=CC=CC=C5

InChI

InChI=1S/C26H24N6/c1-4-10-20(11-5-1)16-27-25-23-24(32(19-29-23)18-22-14-8-3-9-15-22)26(31-30-25)28-17-21-12-6-2-7-13-21/h1-15,19H,16-18H2,(H,27,30)(H,28,31)