5-fluoranyl-2-[(1S)-1-[(2-fluoranyl-7H-purin-6-yl)amino]ethyl]-3-phenyl-quinazolin-4-one

Systemtic Name: 5-fluoranyl-2-[(1S)-1-[(2-fluoranyl-7H-purin-6-yl)amino]ethyl]-3-phenyl-quinazolin-4-one Openeye Name: 5-fluoro-2-[(1S)-1-[(2-fluoro-7H-purin-6-yl)amino]ethyl]-3-phenyl-quinazolin-4-one CAS Name: 5-fluoro-2-[(1S)-1-[(2-fluoro-7H-purin-6-yl)amino]ethyl]-3-phenyl-4-quinazolinone IUPAC Name: 5-fluoro-2-[(1S)-1-[(2-fluoro-7H-purin-6-yl)amino]ethyl]-3-phenylquinazolin-4-one Traditional Name: 5-fluoro-2-[(1S)-1-[(2-fluoro-7H-purin-6-yl)amino]ethyl]-3-phenyl-quinazolin-4-one Formula: C21H15F2N7O MolecularWeight: 419.386906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(C(=CC=C2)F)C(=O)N1C3=CC=CC=C3)NC4=NC(=NC5=C4NC=N5)F

Isomeric SMILES

C[C@@H](C1=NC2=C(C(=CC=C2)F)C(=O)N1C3=CC=CC=C3)NC4=NC(=NC5=C4NC=N5)F

InChI

InChI=1S/C21H15F2N7O/c1-11(26-18-16-17(25-10-24-16)28-21(23)29-18)19-27-14-9-5-8-13(22)15(14)20(31)30(19)12-6-3-2-4-7-12/h2-11H,1H3,(H2,24,25,26,28,29)/t11-/m0/s1