2-(3-aminocarbonylphenyl)-9-(2-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 2-(3-aminocarbonylphenyl)-9-(2-methoxyphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-(3-carbamoylphenyl)-9-(2-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 2-(3-carbamoylphenyl)-9-(2-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-(3-carbamoylphenyl)-9-(2-methoxyphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-(3-carbamoylphenyl)-8-keto-9-(2-methoxyphenyl)-7H-purine-6-carboxamide Formula: C20H16N6O4 MolecularWeight: 404.37884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC(=CC=C4)C(=O)N

Isomeric SMILES

COC1=CC=CC=C1N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC(=CC=C4)C(=O)N

InChI

InChI=1S/C20H16N6O4/c1-30-13-8-3-2-7-12(13)26-19-15(24-20(26)29)14(17(22)28)23-18(25-19)11-6-4-5-10(9-11)16(21)27/h2-9H,1H3,(H2,21,27)(H2,22,28)(H,24,29)