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

Systemtic Name: 9-[2,6-bis(fluoranyl)phenyl]-2-(3-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(2,6-difluorophenyl)-2-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(2,6-difluorophenyl)-2-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(2,6-difluorophenyl)-2-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-(2,6-difluorophenyl)-8-keto-2-(3-methoxyphenyl)-7H-purine-6-carboxamide Formula: C19H13F2N5O3 MolecularWeight: 397.335026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=C(C=CC=C4F)F)C(=O)N

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=C(C=CC=C4F)F)C(=O)N

InChI

InChI=1S/C19H13F2N5O3/c1-29-10-5-2-4-9(8-10)17-23-13(16(22)27)14-18(25-17)26(19(28)24-14)15-11(20)6-3-7-12(15)21/h2-8H,1H3,(H2,22,27)(H,24,28)