N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[2-(1H-indol-3-yl)ethyl]purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[2-(1H-indol-3-yl)ethyl]purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[2-(1H-indol-3-yl)ethyl]purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[2-(1H-indol-3-yl)ethyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[2-(1H-indol-3-yl)ethyl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[2-(1H-indol-3-yl)ethylamino]purin-2-yl]amine Formula: C26H34N8 MolecularWeight: 458.60176

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCC4=CNC5=CC=CC=C54)NC6CCC(CC6)N

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCC4=CNC5=CC=CC=C54)NC6CCC(CC6)N

InChI

InChI=1S/C26H34N8/c27-18-9-11-19(12-10-18)31-26-32-24(23-25(33-26)34(16-30-23)20-5-1-2-6-20)28-14-13-17-15-29-22-8-4-3-7-21(17)22/h3-4,7-8,15-16,18-20,29H,1-2,5-6,9-14,27H2,(H2,28,31,32,33)