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

Systemtic Name: N8-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[4-(1-propoxypropyl)piperidin-1-yl]purine-6,8-diamine Openeye Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(1-propoxypropyl)-1-piperidyl]purine-6,8-diamine CAS Name: N8-(4-aminocyclohexyl)-9-cyclopentyl-N6-[4-(1-propoxypropyl)-1-piperidinyl]purine-6,8-diamine IUPAC Name: 8-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[4-(1-propoxypropyl)piperidin-1-yl]purine-6,8-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[[4-(1-propoxypropyl)piperidino]amino]purin-8-yl]amine Formula: C27H46N8O MolecularWeight: 498.70714

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(CC)C1CCN(CC1)NC2=NC=NC3=C2N=C(N3C4CCCC4)NC5CCC(CC5)N

Isomeric SMILES

CCCOC(CC)C1CCN(CC1)NC2=NC=NC3=C2N=C(N3C4CCCC4)NC5CCC(CC5)N

InChI

InChI=1S/C27H46N8O/c1-3-17-36-23(4-2)19-13-15-34(16-14-19)33-25-24-26(30-18-29-25)35(22-7-5-6-8-22)27(32-24)31-21-11-9-20(28)10-12-21/h18-23H,3-17,28H2,1-2H3,(H,31,32)(H,29,30,33)