N2-(4-azanylcyclohexyl)-9-methyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-9-methyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-methyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-methyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-methyl-6-N-[(4-phenylphenyl)methyl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-methyl-6-[(4-phenylbenzyl)amino]purin-2-yl]amine Formula: C25H29N7 MolecularWeight: 427.54466

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)N

Isomeric SMILES

CN1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)N

InChI

InChI=1S/C25H29N7/c1-32-16-28-22-23(30-25(31-24(22)32)29-21-13-11-20(26)12-14-21)27-15-17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-10,16,20-21H,11-15,26H2,1H3,(H2,27,29,30,31)