9-[2,6-bis(fluoranyl)phenyl]-2-(4-ethylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-[2,6-bis(fluoranyl)phenyl]-2-(4-ethylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(2,6-difluorophenyl)-2-(4-ethylphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(2,6-difluorophenyl)-2-(4-ethylphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(2,6-difluorophenyl)-2-(4-ethylphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-(2,6-difluorophenyl)-2-(4-ethylphenyl)-8-keto-7H-purine-6-carboxamide Formula: C20H15F2N5O2 MolecularWeight: 395.362206

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=C(C=CC=C4F)F)C(=O)N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=C(C=CC=C4F)F)C(=O)N

InChI

InChI=1S/C20H15F2N5O2/c1-2-10-6-8-11(9-7-10)18-24-14(17(23)28)15-19(26-18)27(20(29)25-15)16-12(21)4-3-5-13(16)22/h3-9H,2H2,1H3,(H2,23,28)(H,25,29)