5-[9-(2,2-dimethylpropyl)-2-morpholin-4-yl-purin-6-yl]pyrimidin-2-amine

Systemtic Name: 5-[9-(2,2-dimethylpropyl)-2-morpholin-4-yl-purin-6-yl]pyrimidin-2-amine Openeye Name: 5-[9-(2,2-dimethylpropyl)-2-morpholino-purin-6-yl]pyrimidin-2-amine CAS Name: 5-[9-(2,2-dimethylpropyl)-2-(4-morpholinyl)-6-purinyl]-2-pyrimidinamine IUPAC Name: 5-[9-(2,2-dimethylpropyl)-2-morpholin-4-ylpurin-6-yl]pyrimidin-2-amine Traditional Name: [5-(2-morpholino-9-neopentyl-purin-6-yl)pyrimidin-2-yl]amine Formula: C18H24N8O MolecularWeight: 368.43616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C=NC2=C(N=C(N=C21)N3CCOCC3)C4=CN=C(N=C4)N

Isomeric SMILES

CC(C)(C)CN1C=NC2=C(N=C(N=C21)N3CCOCC3)C4=CN=C(N=C4)N

InChI

InChI=1S/C18H24N8O/c1-18(2,3)10-26-11-22-14-13(12-8-20-16(19)21-9-12)23-17(24-15(14)26)25-4-6-27-7-5-25/h8-9,11H,4-7,10H2,1-3H3,(H2,19,20,21)