2-[3,4-bis(fluoranyl)phenyl]-9-(4-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 2-[3,4-bis(fluoranyl)phenyl]-9-(4-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-(3,4-difluorophenyl)-9-(4-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-(3,4-difluorophenyl)-9-(4-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-(3,4-difluorophenyl)-9-(4-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-(3,4-difluorophenyl)-8-keto-9-(4-methoxyphenyl)-7H-purine-6-carboxamide Formula: C19H13F2N5O3 MolecularWeight: 397.335026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC(=C(C=C4)F)F

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC(=C(C=C4)F)F

InChI

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