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

Systemtic Name: N6-(4-azanylcyclohexyl)-9-cyclopentyl-N2-(4-pentylpiperidin-1-yl)purine-2,6-diamine; N-butylbutan-1-amine Openeye Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-(4-pentyl-1-piperidyl)purine-2,6-diamine; N-butylbutan-1-amine CAS Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-(4-pentyl-1-piperidinyl)purine-2,6-diamine; N-butyl-1-butanamine IUPAC Name: 6-N-(4-aminocyclohexyl)-9-cyclopentyl-2-N-(4-pentylpiperidin-1-yl)purine-2,6-diamine; N-butylbutan-1-amine Traditional Name: (4-aminocyclohexyl)-[2-[(4-amylpiperidino)amino]-9-cyclopentyl-purin-6-yl]amine; dibutylamine Formula: C34H63N9 MolecularWeight: 597.92432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCN(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5.CCCCNCCCC

Isomeric SMILES

CCCCCC1CCN(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5.CCCCNCCCC

InChI

InChI=1S/C26H44N8.C8H19N/c1-2-3-4-7-19-14-16-33(17-15-19)32-26-30-24(29-21-12-10-20(27)11-13-21)23-25(31-26)34(18-28-23)22-8-5-6-9-22;1-3-5-7-9-8-6-4-2/h18-22H,2-17,27H2,1H3,(H2,29,30,31,32);9H,3-8H2,1-2H3