N-(2-butylpiperidin-4-yl)-2-chloranyl-9-cyclopentyl-purin-6-amine; N-ethylethanamine

Systemtic Name: N-(2-butylpiperidin-4-yl)-2-chloranyl-9-cyclopentyl-purin-6-amine; N-ethylethanamine Openeye Name: N-(2-butyl-4-piperidyl)-2-chloro-9-cyclopentyl-purin-6-amine; N-ethylethanamine CAS Name: N-(2-butyl-4-piperidinyl)-2-chloro-9-cyclopentyl-6-purinamine; N-ethylethanamine IUPAC Name: N-(2-butylpiperidin-4-yl)-2-chloro-9-cyclopentylpurin-6-amine; N-ethylethanamine Traditional Name: (2-butyl-4-piperidyl)-(2-chloro-9-cyclopentyl-purin-6-yl)amine; diethylamine Formula: C23H40ClN7 MolecularWeight: 450.0636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(CCN1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl.CCNCC

Isomeric SMILES

CCCCC1CC(CCN1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl.CCNCC

InChI

InChI=1S/C19H29ClN6.C4H11N/c1-2-3-6-13-11-14(9-10-21-13)23-17-16-18(25-19(20)24-17)26(12-22-16)15-7-4-5-8-15;1-3-5-4-2/h12-15,21H,2-11H2,1H3,(H,23,24,25);5H,3-4H2,1-2H3