ethyl 4-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidine-1-carboxylate dihydrochloride

Systemtic Name: ethyl 4-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidine-1-carboxylate dihydrochloride Openeye Name: ethyl 4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidine-1-carboxylate dihydrochloride CAS Name: 4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-6-purinyl]amino]-1-piperidinecarboxylic acid ethyl ester dihydrochloride IUPAC Name: ethyl 4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentylpurin-6-yl]amino]piperidine-1-carboxylate dihydrochloride Traditional Name: 4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidine-1-carboxylic acid ethyl ester dihydrochloride Formula: C24H40Cl2N8O2 MolecularWeight: 543.5328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N.Cl.Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)NC5CCC(CC5)N.Cl.Cl

InChI

InChI=1S/C24H38N8O2.2ClH/c1-2-34-24(33)31-13-11-18(12-14-31)27-21-20-22(32(15-26-20)19-5-3-4-6-19)30-23(29-21)28-17-9-7-16(25)8-10-17;;/h15-19H,2-14,25H2,1H3,(H2,27,28,29,30);2*1H