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

Systemtic Name: 2-(2-chloranyl-6-fluoranyl-phenyl)-9-(3-methoxyphenyl)-7-methyl-8-oxidanylidene-purine-6-carboxamide Openeye Name: 2-(2-chloro-6-fluoro-phenyl)-9-(3-methoxyphenyl)-7-methyl-8-oxo-purine-6-carboxamide CAS Name: 2-(2-chloro-6-fluorophenyl)-9-(3-methoxyphenyl)-7-methyl-8-oxo-6-purinecarboxamide IUPAC Name: 2-(2-chloro-6-fluorophenyl)-9-(3-methoxyphenyl)-7-methyl-8-oxopurine-6-carboxamide Traditional Name: 2-(2-chloro-6-fluoro-phenyl)-8-keto-9-(3-methoxyphenyl)-7-methyl-purine-6-carboxamide Formula: C20H15ClFN5O3 MolecularWeight: 427.816203

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C(N=C2N(C1=O)C3=CC(=CC=C3)OC)C4=C(C=CC=C4Cl)F)C(=O)N

Isomeric SMILES

CN1C2=C(N=C(N=C2N(C1=O)C3=CC(=CC=C3)OC)C4=C(C=CC=C4Cl)F)C(=O)N

InChI

InChI=1S/C20H15ClFN5O3/c1-26-16-15(17(23)28)24-18(14-12(21)7-4-8-13(14)22)25-19(16)27(20(26)29)10-5-3-6-11(9-10)30-2/h3-9H,1-2H3,(H2,23,28)