9-[(4-methylphenyl)methyl]-N6-(phenylmethyl)-N8-(2-phenylphenyl)purine-6,8-diamine

Systemtic Name: 9-[(4-methylphenyl)methyl]-N6-(phenylmethyl)-N8-(2-phenylphenyl)purine-6,8-diamine Openeye Name: N6-benzyl-N8-(2-phenylphenyl)-9-(p-tolylmethyl)purine-6,8-diamine CAS Name: 9-[(4-methylphenyl)methyl]-N6-(phenylmethyl)-N8-(2-phenylphenyl)purine-6,8-diamine IUPAC Name: 6-N-benzyl-9-[(4-methylphenyl)methyl]-8-N-(2-phenylphenyl)purine-6,8-diamine Traditional Name: benzyl-[9-(4-methylbenzyl)-8-(2-phenylanilino)purin-6-yl]amine Formula: C32H28N6 MolecularWeight: 496.60492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=C(C(=NC=N3)NCC4=CC=CC=C4)N=C2NC5=CC=CC=C5C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=C(C(=NC=N3)NCC4=CC=CC=C4)N=C2NC5=CC=CC=C5C6=CC=CC=C6

InChI

InChI=1S/C32H28N6/c1-23-16-18-25(19-17-23)21-38-31-29(30(34-22-35-31)33-20-24-10-4-2-5-11-24)37-32(38)36-28-15-9-8-14-27(28)26-12-6-3-7-13-26/h2-19,22H,20-21H2,1H3,(H,36,37)(H,33,34,35)