7-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(4-tert-butyl-2,6-dimethyl-benzyl)-1,3-dimethyl-xanthine Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CN2C=NC3=C2C(=O)N(C(=O)N3C)C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CN2C=NC3=C2C(=O)N(C(=O)N3C)C)C)C(C)(C)C

InChI

InChI=1S/C20H26N4O2/c1-12-8-14(20(3,4)5)9-13(2)15(12)10-24-11-21-17-16(24)18(25)23(7)19(26)22(17)6/h8-9,11H,10H2,1-7H3