3-[9-[(3-fluorophenyl)methyl]-2-morpholin-4-yl-purin-6-yl]phenol

Systemtic Name: 3-[9-[(3-fluorophenyl)methyl]-2-morpholin-4-yl-purin-6-yl]phenol Openeye Name: 3-[9-[(3-fluorophenyl)methyl]-2-morpholino-purin-6-yl]phenol CAS Name: 3-[9-[(3-fluorophenyl)methyl]-2-(4-morpholinyl)-6-purinyl]phenol IUPAC Name: 3-[9-[(3-fluorophenyl)methyl]-2-morpholin-4-ylpurin-6-yl]phenol Traditional Name: 3-[9-(3-fluorobenzyl)-2-morpholino-purin-6-yl]phenol Formula: C22H20FN5O2 MolecularWeight: 405.424903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=C3C(=N2)N(C=N3)CC4=CC(=CC=C4)F)C5=CC(=CC=C5)O

Isomeric SMILES

C1COCCN1C2=NC(=C3C(=N2)N(C=N3)CC4=CC(=CC=C4)F)C5=CC(=CC=C5)O

InChI

InChI=1S/C22H20FN5O2/c23-17-5-1-3-15(11-17)13-28-14-24-20-19(16-4-2-6-18(29)12-16)25-22(26-21(20)28)27-7-9-30-10-8-27/h1-6,11-12,14,29H,7-10,13H2