N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(5-ethoxypentyl)piperidin-1-yl]purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(5-ethoxypentyl)piperidin-1-yl]purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(5-ethoxypentyl)-1-piperidyl]purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(5-ethoxypentyl)-1-piperidinyl]purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[4-(5-ethoxypentyl)piperidin-1-yl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[[4-(5-ethoxypentyl)piperidino]amino]purin-2-yl]amine Formula: C28H48N8O MolecularWeight: 512.73372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCCCC1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N

Isomeric SMILES

CCOCCCCCC1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N

InChI

InChI=1S/C28H48N8O/c1-2-37-19-7-3-4-8-21-15-17-35(18-16-21)34-26-25-27(36(20-30-25)24-9-5-6-10-24)33-28(32-26)31-23-13-11-22(29)12-14-23/h20-24H,2-19,29H2,1H3,(H2,31,32,33,34)