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

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[(4-phenylphenyl)methyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[(4-phenylphenyl)methyl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[(4-phenylbenzyl)amino]purin-2-yl]amine Formula: C29H35N7 MolecularWeight: 481.6351

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCC4=CC=C(C=C4)C5=CC=CC=C5)NC6CCC(CC6)N

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCC4=CC=C(C=C4)C5=CC=CC=C5)NC6CCC(CC6)N

InChI

InChI=1S/C29H35N7/c30-23-14-16-24(17-15-23)33-29-34-27(26-28(35-29)36(19-32-26)25-8-4-5-9-25)31-18-20-10-12-22(13-11-20)21-6-2-1-3-7-21/h1-3,6-7,10-13,19,23-25H,4-5,8-9,14-18,30H2,(H2,31,33,34,35)