5-[9-[(2S)-butan-2-yl]-2-morpholin-4-yl-purin-6-yl]pyrimidin-2-amine

Systemtic Name: 5-[9-[(2S)-butan-2-yl]-2-morpholin-4-yl-purin-6-yl]pyrimidin-2-amine Openeye Name: 5-[9-[(1S)-1-methylpropyl]-2-morpholino-purin-6-yl]pyrimidin-2-amine CAS Name: 5-[9-[(2S)-butan-2-yl]-2-(4-morpholinyl)-6-purinyl]-2-pyrimidinamine IUPAC Name: 5-[9-[(2S)-butan-2-yl]-2-morpholin-4-ylpurin-6-yl]pyrimidin-2-amine Traditional Name: [5-[9-[(1S)-1-methylpropyl]-2-morpholino-purin-6-yl]pyrimidin-2-yl]amine Formula: C17H22N8O MolecularWeight: 354.40958

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=NC2=C(N=C(N=C21)N3CCOCC3)C4=CN=C(N=C4)N

Isomeric SMILES

CC[C@H](C)N1C=NC2=C(N=C(N=C21)N3CCOCC3)C4=CN=C(N=C4)N

InChI

InChI=1S/C17H22N8O/c1-3-11(2)25-10-21-14-13(12-8-19-16(18)20-9-12)22-17(23-15(14)25)24-4-6-26-7-5-24/h8-11H,3-7H2,1-2H3,(H2,18,19,20)/t11-/m0/s1