N6-(4-azanylcyclohexyl)-9-cyclopentyl-N2-[2-[2-(3-methylpyrrolidin-1-yl)ethyl]piperidin-4-yl]purine-2,6-diamine

Systemtic Name: N6-(4-azanylcyclohexyl)-9-cyclopentyl-N2-[2-[2-(3-methylpyrrolidin-1-yl)ethyl]piperidin-4-yl]purine-2,6-diamine Openeye Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-[2-[2-(3-methylpyrrolidin-1-yl)ethyl]-4-piperidyl]purine-2,6-diamine CAS Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-[2-[2-(3-methyl-1-pyrrolidinyl)ethyl]-4-piperidinyl]purine-2,6-diamine IUPAC Name: 6-N-(4-aminocyclohexyl)-9-cyclopentyl-2-N-[2-[2-(3-methylpyrrolidin-1-yl)ethyl]piperidin-4-yl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-2-[[2-[2-(3-methylpyrrolidino)ethyl]-4-piperidyl]amino]purin-6-yl]amine Formula: C28H47N9 MolecularWeight: 509.73308

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C1)CCC2CC(CCN2)NC3=NC4=C(C(=N3)NC5CCC(CC5)N)N=CN4C6CCCC6

Isomeric SMILES

CC1CCN(C1)CCC2CC(CCN2)NC3=NC4=C(C(=N3)NC5CCC(CC5)N)N=CN4C6CCCC6

InChI

InChI=1S/C28H47N9/c1-19-11-14-36(17-19)15-12-22-16-23(10-13-30-22)33-28-34-26(32-21-8-6-20(29)7-9-21)25-27(35-28)37(18-31-25)24-4-2-3-5-24/h18-24,30H,2-17,29H2,1H3,(H2,32,33,34,35)