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

Systemtic Name: 2,9-bis(4-methylphenyl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 8-oxo-2,9-bis(p-tolyl)-7H-purine-6-carboxamide CAS Name: 2,9-bis(4-methylphenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 2,9-bis(4-methylphenyl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 8-keto-2,9-bis(p-tolyl)-7H-purine-6-carboxamide Formula: C20H17N5O2 MolecularWeight: 359.38128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=C(C=C4)C)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=C(C=C4)C)C(=O)N

InChI

InChI=1S/C20H17N5O2/c1-11-3-7-13(8-4-11)18-22-15(17(21)26)16-19(24-18)25(20(27)23-16)14-9-5-12(2)6-10-14/h3-10H,1-2H3,(H2,21,26)(H,23,27)