9-[2,6-bis(fluoranyl)phenyl]-2-(3-chlorophenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-[2,6-bis(fluoranyl)phenyl]-2-(3-chlorophenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-(3-chlorophenyl)-9-(2,6-difluorophenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-(3-chlorophenyl)-9-(2,6-difluorophenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-(3-chlorophenyl)-9-(2,6-difluorophenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-(3-chlorophenyl)-9-(2,6-difluorophenyl)-8-keto-7H-purine-6-carboxamide Formula: C18H10ClF2N5O2 MolecularWeight: 401.754106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H10ClF2N5O2/c19-9-4-1-3-8(7-9)16-23-12(15(22)27)13-17(25-16)26(18(28)24-13)14-10(20)5-2-6-11(14)21/h1-7H,(H2,22,27)(H,24,28)