N6-(4-azanylcyclohexyl)-9-cyclopentyl-N2-(4-ethylpiperidin-1-yl)purine-2,6-diamine; N-butylbutan-1-amine

Systemtic Name: N6-(4-azanylcyclohexyl)-9-cyclopentyl-N2-(4-ethylpiperidin-1-yl)purine-2,6-diamine; N-butylbutan-1-amine Openeye Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-(4-ethyl-1-piperidyl)purine-2,6-diamine; N-butylbutan-1-amine CAS Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-(4-ethyl-1-piperidinyl)purine-2,6-diamine; N-butyl-1-butanamine IUPAC Name: 6-N-(4-aminocyclohexyl)-9-cyclopentyl-2-N-(4-ethylpiperidin-1-yl)purine-2,6-diamine; N-butylbutan-1-amine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-2-[(4-ethylpiperidino)amino]purin-6-yl]amine; dibutylamine Formula: C31H57N9 MolecularWeight: 555.84458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCC.CCC1CCN(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

Isomeric SMILES

CCCCNCCCC.CCC1CCN(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

InChI

InChI=1S/C23H38N8.C8H19N/c1-2-16-11-13-30(14-12-16)29-23-27-21(26-18-9-7-17(24)8-10-18)20-22(28-23)31(15-25-20)19-5-3-4-6-19;1-3-5-7-9-8-6-4-2/h15-19H,2-14,24H2,1H3,(H2,26,27,28,29);9H,3-8H2,1-2H3