7-tert-butyl-2,4-dimethyl-6-[(4-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 7-tert-butyl-2,4-dimethyl-6-[(4-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione Openeye Name: 7-tert-butyl-2,4-dimethyl-6-(p-tolylmethyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 7-tert-butyl-2,4-dimethyl-6-[(4-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione IUPAC Name: 7-tert-butyl-2,4-dimethyl-6-[(4-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione Traditional Name: 7-tert-butyl-2,4-dimethyl-6-(4-methylbenzyl)purin[7,8-a]imidazole-1,3-quinone Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C)C(C)(C)C

InChI

InChI=1S/C21H25N5O2/c1-13-7-9-14(10-8-13)11-25-15(21(2,3)4)12-26-16-17(22-19(25)26)23(5)20(28)24(6)18(16)27/h7-10,12H,11H2,1-6H3