N8-(4-azanylcyclohexyl)-9-cyclopentyl-N6-(4-pentylphenyl)purine-6,8-diamine

Systemtic Name: N8-(4-azanylcyclohexyl)-9-cyclopentyl-N6-(4-pentylphenyl)purine-6,8-diamine Openeye Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-(4-pentylphenyl)purine-6,8-diamine CAS Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-(4-pentylphenyl)purine-6,8-diamine IUPAC Name: 8-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-(4-pentylphenyl)purine-6,8-diamine Traditional Name: (4-aminocyclohexyl)-[6-(4-amylanilino)-9-cyclopentyl-purin-8-yl]amine Formula: C27H39N7 MolecularWeight: 461.64546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC2=NC=NC3=C2N=C(N3C4CCCC4)NC5CCC(CC5)N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC2=NC=NC3=C2N=C(N3C4CCCC4)NC5CCC(CC5)N

InChI

InChI=1S/C27H39N7/c1-2-3-4-7-19-10-14-21(15-11-19)31-25-24-26(30-18-29-25)34(23-8-5-6-9-23)27(33-24)32-22-16-12-20(28)13-17-22/h10-11,14-15,18,20,22-23H,2-9,12-13,16-17,28H2,1H3,(H,32,33)(H,29,30,31)