N8-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(oxolan-3-ylmethyl)piperidin-1-yl]purine-6,8-diamine

Systemtic Name: N8-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(oxolan-3-ylmethyl)piperidin-1-yl]purine-6,8-diamine Openeye Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(tetrahydrofuran-3-ylmethyl)-1-piperidyl]purine-6,8-diamine CAS Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(3-oxolanylmethyl)-1-piperidinyl]purine-6,8-diamine IUPAC Name: 8-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[4-(oxolan-3-ylmethyl)piperidin-1-yl]purine-6,8-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[[4-(tetrahydrofuran-3-ylmethyl)piperidino]amino]purin-8-yl]amine Formula: C26H42N8O MolecularWeight: 482.66468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C(=NC=N3)NN4CCC(CC4)CC5CCOC5)N=C2NC6CCC(CC6)N

Isomeric SMILES

C1CCC(C1)N2C3=C(C(=NC=N3)NN4CCC(CC4)CC5CCOC5)N=C2NC6CCC(CC6)N

InChI

InChI=1S/C26H42N8O/c27-20-5-7-21(8-6-20)30-26-31-23-24(28-17-29-25(23)34(26)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,(H,30,31)(H,28,29,32)