N6-[(4-methoxyphenyl)methyl]-N2-(2-methylphenyl)-9-propan-2-yl-purine-2,6-diamine

Systemtic Name: N6-[(4-methoxyphenyl)methyl]-N2-(2-methylphenyl)-9-propan-2-yl-purine-2,6-diamine Openeye Name: 9-isopropyl-N6-[(4-methoxyphenyl)methyl]-N2-(o-tolyl)purine-2,6-diamine CAS Name: N6-[(4-methoxyphenyl)methyl]-N2-(2-methylphenyl)-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 6-N-[(4-methoxyphenyl)methyl]-2-N-(2-methylphenyl)-9-propan-2-ylpurine-2,6-diamine Traditional Name: [9-isopropyl-2-(o-toluidino)purin-6-yl]-p-anisyl-amine Formula: C23H26N6O MolecularWeight: 402.49214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC3=C(C(=N2)NCC4=CC=C(C=C4)OC)N=CN3C(C)C

Isomeric SMILES

CC1=CC=CC=C1NC2=NC3=C(C(=N2)NCC4=CC=C(C=C4)OC)N=CN3C(C)C

InChI

InChI=1S/C23H26N6O/c1-15(2)29-14-25-20-21(24-13-17-9-11-18(30-4)12-10-17)27-23(28-22(20)29)26-19-8-6-5-7-16(19)3/h5-12,14-15H,13H2,1-4H3,(H2,24,26,27,28)