2-[8-(9-methylpurin-6-yl)-3,8-diazabicyclo[3.2.1]octan-3-yl]-N-quinolin-5-yl-ethanamide

Systemtic Name: 2-[8-(9-methylpurin-6-yl)-3,8-diazabicyclo[3.2.1]octan-3-yl]-N-quinolin-5-yl-ethanamide Openeye Name: 2-[8-(9-methylpurin-6-yl)-3,8-diazabicyclo[3.2.1]octan-3-yl]-N-(5-quinolyl)acetamide CAS Name: 2-[8-(9-methyl-6-purinyl)-3,8-diazabicyclo[3.2.1]octan-3-yl]-N-(5-quinolinyl)acetamide IUPAC Name: 2-[8-(9-methylpurin-6-yl)-3,8-diazabicyclo[3.2.1]octan-3-yl]-N-quinolin-5-ylacetamide Traditional Name: 2-[8-(9-methylpurin-6-yl)-3,8-diazabicyclo[3.2.1]octan-3-yl]-N-(5-quinolyl)acetamide Formula: C23H24N8O MolecularWeight: 428.48966

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N=CN=C2N3C4CCC3CN(C4)CC(=O)NC5=CC=CC6=C5C=CC=N6

Isomeric SMILES

CN1C=NC2=C1N=CN=C2N3C4CCC3CN(C4)CC(=O)NC5=CC=CC6=C5C=CC=N6

InChI

InChI=1S/C23H24N8O/c1-29-14-27-21-22(29)25-13-26-23(21)31-15-7-8-16(31)11-30(10-15)12-20(32)28-19-6-2-5-18-17(19)4-3-9-24-18/h2-6,9,13-16H,7-8,10-12H2,1H3,(H,28,32)