2-methoxy-4-[2-[(9-propan-2-yl-2-pyridin-3-yl-purin-6-yl)amino]ethyl]phenol

Systemtic Name: 2-methoxy-4-[2-[(9-propan-2-yl-2-pyridin-3-yl-purin-6-yl)amino]ethyl]phenol Openeye Name: 4-[2-[[9-isopropyl-2-(3-pyridyl)purin-6-yl]amino]ethyl]-2-methoxy-phenol CAS Name: 2-methoxy-4-[2-[[9-propan-2-yl-2-(3-pyridinyl)-6-purinyl]amino]ethyl]phenol IUPAC Name: 2-methoxy-4-[2-[(9-propan-2-yl-2-pyridin-3-ylpurin-6-yl)amino]ethyl]phenol Traditional Name: 4-[2-[[9-isopropyl-2-(3-pyridyl)purin-6-yl]amino]ethyl]-2-methoxy-phenol Formula: C22H24N6O2 MolecularWeight: 404.46496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCCC3=CC(=C(C=C3)O)OC)C4=CN=CC=C4

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCCC3=CC(=C(C=C3)O)OC)C4=CN=CC=C4

InChI

InChI=1S/C22H24N6O2/c1-14(2)28-13-25-19-21(24-10-8-15-6-7-17(29)18(11-15)30-3)26-20(27-22(19)28)16-5-4-9-23-12-16/h4-7,9,11-14,29H,8,10H2,1-3H3,(H,24,26,27)