2,7-dimethyl-6-(2,4,6-trimethylphenyl)-9H-purin-8-one

Systemtic Name: 2,7-dimethyl-6-(2,4,6-trimethylphenyl)-9H-purin-8-one Openeye Name: 2,7-dimethyl-6-(2,4,6-trimethylphenyl)-9H-purin-8-one CAS Name: 2,7-dimethyl-6-(2,4,6-trimethylphenyl)-9H-purin-8-one IUPAC Name: 2,7-dimethyl-6-(2,4,6-trimethylphenyl)-9H-purin-8-one Traditional Name: 6-mesityl-2,7-dimethyl-9H-purin-8-one Formula: C16H18N4O MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=C3C(=NC(=N2)C)NC(=O)N3C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=C3C(=NC(=N2)C)NC(=O)N3C)C

InChI

InChI=1S/C16H18N4O/c1-8-6-9(2)12(10(3)7-8)13-14-15(18-11(4)17-13)19-16(21)20(14)5/h6-7H,1-5H3,(H,17,18,19,21)