2-(2-chloranyl-6-fluoranyl-phenyl)-9-(3-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 2-(2-chloranyl-6-fluoranyl-phenyl)-9-(3-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-(2-chloro-6-fluoro-phenyl)-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-(2-chloro-6-fluorophenyl)-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-(2-chloro-6-fluorophenyl)-9-(3-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-(2-chloro-6-fluoro-phenyl)-8-keto-9-(3-methoxyphenyl)-7H-purine-6-carboxamide Formula: C19H13ClFN5O3 MolecularWeight: 413.789623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=C(C=CC=C4Cl)F

Isomeric SMILES

COC1=CC=CC(=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C19H13ClFN5O3/c1-29-10-5-2-4-9(8-10)26-18-15(24-19(26)28)14(16(22)27)23-17(25-18)13-11(20)6-3-7-12(13)21/h2-8H,1H3,(H2,22,27)(H,24,28)