N-[3-[2-(cyclopentylamino)ethyl]phenyl]-9-ethyl-8-pyridin-4-yl-purin-2-amine

Systemtic Name: N-[3-[2-(cyclopentylamino)ethyl]phenyl]-9-ethyl-8-pyridin-4-yl-purin-2-amine Openeye Name: N-[3-[2-(cyclopentylamino)ethyl]phenyl]-9-ethyl-8-(4-pyridyl)purin-2-amine CAS Name: N-[3-[2-(cyclopentylamino)ethyl]phenyl]-9-ethyl-8-pyridin-4-yl-2-purinamine IUPAC Name: N-[3-[2-(cyclopentylamino)ethyl]phenyl]-9-ethyl-8-pyridin-4-ylpurin-2-amine Traditional Name: cyclopentyl-[2-[3-[[9-ethyl-8-(4-pyridyl)purin-2-yl]amino]phenyl]ethyl]amine Formula: C25H29N7 MolecularWeight: 427.54466

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=CN=C(N=C21)NC3=CC=CC(=C3)CCNC4CCCC4)C5=CC=NC=C5

Isomeric SMILES

CCN1C(=NC2=CN=C(N=C21)NC3=CC=CC(=C3)CCNC4CCCC4)C5=CC=NC=C5

InChI

InChI=1S/C25H29N7/c1-2-32-23(19-11-13-26-14-12-19)30-22-17-28-25(31-24(22)32)29-21-9-5-6-18(16-21)10-15-27-20-7-3-4-8-20/h5-6,9,11-14,16-17,20,27H,2-4,7-8,10,15H2,1H3,(H,28,29,31)