[4-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidin-1-yl]-cyclopentyl-methanone

Systemtic Name: [4-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidin-1-yl]-cyclopentyl-methanone Openeye Name: [4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]-1-piperidyl]-cyclopentyl-methanone CAS Name: [4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-6-purinyl]amino]-1-piperidinyl]-cyclopentylmethanone IUPAC Name: [4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentylpurin-6-yl]amino]piperidin-1-yl]-cyclopentylmethanone Traditional Name: [4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidino]-cyclopentyl-methanone Formula: C27H42N8O MolecularWeight: 494.67538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)N2CCC(CC2)NC3=NC(=NC4=C3N=CN4C5CCCC5)NC6CCC(CC6)N

Isomeric SMILES

C1CCC(C1)C(=O)N2CCC(CC2)NC3=NC(=NC4=C3N=CN4C5CCCC5)NC6CCC(CC6)N

InChI

InChI=1S/C27H42N8O/c28-19-9-11-20(12-10-19)31-27-32-24(23-25(33-27)35(17-29-23)22-7-3-4-8-22)30-21-13-15-34(16-14-21)26(36)18-5-1-2-6-18/h17-22H,1-16,28H2,(H2,30,31,32,33)