N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[1-[(3-methylphenyl)methyl]piperidin-4-yl]-7,8-dihydropurine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-9-cyclopentyl-N6-[1-[(3-methylphenyl)methyl]piperidin-4-yl]-7,8-dihydropurine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[1-(m-tolylmethyl)-4-piperidyl]-7,8-dihydropurine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-9-cyclopentyl-N6-[1-[(3-methylphenyl)methyl]-4-piperidinyl]-7,8-dihydropurine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-9-cyclopentyl-6-N-[1-[(3-methylphenyl)methyl]piperidin-4-yl]-7,8-dihydropurine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-6-[[1-(3-methylbenzyl)-4-piperidyl]amino]-7,8-dihydropurin-2-yl]amine Formula: C29H44N8 MolecularWeight: 504.71326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCC(CC2)NC3=NC(=NC4=C3NCN4C5CCCC5)NC6CCC(CC6)N

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC(CC2)NC3=NC(=NC4=C3NCN4C5CCCC5)NC6CCC(CC6)N

InChI

InChI=1S/C29H44N8/c1-20-5-4-6-21(17-20)18-36-15-13-24(14-16-36)32-27-26-28(37(19-31-26)25-7-2-3-8-25)35-29(34-27)33-23-11-9-22(30)10-12-23/h4-6,17,22-25,31H,2-3,7-16,18-19,30H2,1H3,(H2,32,33,34,35)