9-(4-methylphenyl)-8-oxidanylidene-2-(4-propan-2-ylphenyl)-7H-purine-6-carboxamide

Systemtic Name: 9-(4-methylphenyl)-8-oxidanylidene-2-(4-propan-2-ylphenyl)-7H-purine-6-carboxamide Openeye Name: 2-(4-isopropylphenyl)-8-oxo-9-(p-tolyl)-7H-purine-6-carboxamide CAS Name: 9-(4-methylphenyl)-8-oxo-2-(4-propan-2-ylphenyl)-7H-purine-6-carboxamide IUPAC Name: 9-(4-methylphenyl)-8-oxo-2-(4-propan-2-ylphenyl)-7H-purine-6-carboxamide Traditional Name: 8-keto-2-p-cumenyl-9-(p-tolyl)-7H-purine-6-carboxamide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N5O2/c1-12(2)14-6-8-15(9-7-14)20-24-17(19(23)28)18-21(26-20)27(22(29)25-18)16-10-4-13(3)5-11-16/h4-12H,1-3H3,(H2,23,28)(H,25,29)