N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(oxolan-3-ylmethyl)piperidin-1-yl]purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(oxolan-3-ylmethyl)piperidin-1-yl]purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(tetrahydrofuran-3-ylmethyl)-1-piperidyl]purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(3-oxolanylmethyl)-1-piperidinyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[4-(oxolan-3-ylmethyl)piperidin-1-yl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[[4-(tetrahydrofuran-3-ylmethyl)piperidino]amino]purin-2-yl]amine Formula: C26H42N8O MolecularWeight: 482.66468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CC5CCOC5)NC6CCC(CC6)N

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CC5CCOC5)NC6CCC(CC6)N

InChI

InChI=1S/C26H42N8O/c27-20-5-7-21(8-6-20)29-26-30-24(23-25(31-26)34(17-28-23)22-3-1-2-4-22)32-33-12-9-18(10-13-33)15-19-11-14-35-16-19/h17-22H,1-16,27H2,(H2,29,30,31,32)