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

Systemtic Name: N-butylbutan-1-amine; 2-chloranyl-9-cyclopentyl-N-(4-ethylpiperidin-1-yl)purin-6-amine Openeye Name: N-butylbutan-1-amine; 2-chloro-9-cyclopentyl-N-(4-ethyl-1-piperidyl)purin-6-amine CAS Name: N-butyl-1-butanamine; 2-chloro-9-cyclopentyl-N-(4-ethyl-1-piperidinyl)-6-purinamine IUPAC Name: N-butylbutan-1-amine; 2-chloro-9-cyclopentyl-N-(4-ethylpiperidin-1-yl)purin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-(4-ethylpiperidino)amine; dibutylamine Formula: C25H44ClN7 MolecularWeight: 478.11676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCC.CCC1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl

Isomeric SMILES

CCCCNCCCC.CCC1CCN(CC1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl

InChI

InChI=1S/C17H25ClN6.C8H19N/c1-2-12-7-9-23(10-8-12)22-15-14-16(21-17(18)20-15)24(11-19-14)13-5-3-4-6-13;1-3-5-7-9-8-6-4-2/h11-13H,2-10H2,1H3,(H,20,21,22);9H,3-8H2,1-2H3