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

Systemtic Name: N6-(4-azanylcyclohexyl)-9-cyclopentyl-N2-[1-[4-(diethylamino)butyl]piperidin-4-yl]purine-2,6-diamine Openeye Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-[1-[4-(diethylamino)butyl]-4-piperidyl]purine-2,6-diamine CAS Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-[1-[4-(diethylamino)butyl]-4-piperidinyl]purine-2,6-diamine IUPAC Name: 6-N-(4-aminocyclohexyl)-9-cyclopentyl-2-N-[1-[4-(diethylamino)butyl]piperidin-4-yl]purine-2,6-diamine Traditional Name: 4-[4-[[6-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-2-yl]amino]piperidino]butyl-diethyl-amine Formula: C29H51N9 MolecularWeight: 525.77554

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCN1CCC(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

Isomeric SMILES

CCN(CC)CCCCN1CCC(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

InChI

InChI=1S/C29H51N9/c1-3-36(4-2)17-7-8-18-37-19-15-24(16-20-37)33-29-34-27(32-23-13-11-22(30)12-14-23)26-28(35-29)38(21-31-26)25-9-5-6-10-25/h21-25H,3-20,30H2,1-2H3,(H2,32,33,34,35)