2-[2,3-bis(fluoranyl)-4-methoxy-phenoxy]-9-ethyl-1-(4-fluorophenyl)purin-6-one

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-methoxy-phenoxy]-9-ethyl-1-(4-fluorophenyl)purin-6-one Openeye Name: 2-(2,3-difluoro-4-methoxy-phenoxy)-9-ethyl-1-(4-fluorophenyl)purin-6-one CAS Name: 2-(2,3-difluoro-4-methoxyphenoxy)-9-ethyl-1-(4-fluorophenyl)-6-purinone IUPAC Name: 2-(2,3-difluoro-4-methoxyphenoxy)-9-ethyl-1-(4-fluorophenyl)purin-6-one Traditional Name: 2-(2,3-difluoro-4-methoxy-phenoxy)-9-ethyl-1-(4-fluorophenyl)purin-6-one Formula: C20H15F3N4O3 MolecularWeight: 416.35331

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N(C2=O)C3=CC=C(C=C3)F)OC4=C(C(=C(C=C4)OC)F)F

Isomeric SMILES

CCN1C=NC2=C1N=C(N(C2=O)C3=CC=C(C=C3)F)OC4=C(C(=C(C=C4)OC)F)F

InChI

InChI=1S/C20H15F3N4O3/c1-3-26-10-24-17-18(26)25-20(27(19(17)28)12-6-4-11(21)5-7-12)30-14-9-8-13(29-2)15(22)16(14)23/h4-10H,3H2,1-2H3