2-(2,5-dimethoxyphenyl)-9-(4-methylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 2-(2,5-dimethoxyphenyl)-9-(4-methylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 2-(2,5-dimethoxyphenyl)-8-oxo-9-(p-tolyl)-7H-purine-6-carboxamide CAS Name: 2-(2,5-dimethoxyphenyl)-9-(4-methylphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2-(2,5-dimethoxyphenyl)-9-(4-methylphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 2-(2,5-dimethoxyphenyl)-8-keto-9-(p-tolyl)-7H-purine-6-carboxamide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C21H19N5O4/c1-11-4-6-12(7-5-11)26-20-17(24-21(26)28)16(18(22)27)23-19(25-20)14-10-13(29-2)8-9-15(14)30-3/h4-10H,1-3H3,(H2,22,27)(H,24,28)