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

Systemtic Name: N-[4-[(cyclopentylamino)methyl]phenyl]-9-ethyl-8-pyridin-4-yl-purin-2-amine Openeye Name: N-[4-[(cyclopentylamino)methyl]phenyl]-9-ethyl-8-(4-pyridyl)purin-2-amine CAS Name: N-[4-[(cyclopentylamino)methyl]phenyl]-9-ethyl-8-pyridin-4-yl-2-purinamine IUPAC Name: N-[4-[(cyclopentylamino)methyl]phenyl]-9-ethyl-8-pyridin-4-ylpurin-2-amine Traditional Name: cyclopentyl-[4-[[9-ethyl-8-(4-pyridyl)purin-2-yl]amino]benzyl]amine Formula: C24H27N7 MolecularWeight: 413.51808

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=CN=C(N=C21)NC3=CC=C(C=C3)CNC4CCCC4)C5=CC=NC=C5

Isomeric SMILES

CCN1C(=NC2=CN=C(N=C21)NC3=CC=C(C=C3)CNC4CCCC4)C5=CC=NC=C5

InChI

InChI=1S/C24H27N7/c1-2-31-22(18-11-13-25-14-12-18)29-21-16-27-24(30-23(21)31)28-20-9-7-17(8-10-20)15-26-19-5-3-4-6-19/h7-14,16,19,26H,2-6,15H2,1H3,(H,27,28,30)