N-butylbutan-1-amine; 2-chloranyl-9-cyclopentyl-N-(2-propylpiperidin-4-yl)purin-6-amine

Systemtic Name: N-butylbutan-1-amine; 2-chloranyl-9-cyclopentyl-N-(2-propylpiperidin-4-yl)purin-6-amine Openeye Name: N-butylbutan-1-amine; 2-chloro-9-cyclopentyl-N-(2-propyl-4-piperidyl)purin-6-amine CAS Name: N-butyl-1-butanamine; 2-chloro-9-cyclopentyl-N-(2-propyl-4-piperidinyl)-6-purinamine IUPAC Name: N-butylbutan-1-amine; 2-chloro-9-cyclopentyl-N-(2-propylpiperidin-4-yl)purin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-(2-propyl-4-piperidyl)amine; dibutylamine Formula: C26H46ClN7 MolecularWeight: 492.14334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCC.CCCC1CC(CCN1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl

Isomeric SMILES

CCCCNCCCC.CCCC1CC(CCN1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl

InChI

InChI=1S/C18H27ClN6.C8H19N/c1-2-5-12-10-13(8-9-20-12)22-16-15-17(24-18(19)23-16)25(11-21-15)14-6-3-4-7-14;1-3-5-7-9-8-6-4-2/h11-14,20H,2-10H2,1H3,(H,22,23,24);9H,3-8H2,1-2H3