8-cinnamyl-1,3-dimethyl-7H-purine-2,6-dione

Molecular Formula: C₁₆H₁₆N₄O₂

InChI: InChI=1/C16H16N4O2/c1-19-14-13(15(21)20(2)16(19)22)17-12(18-14)10-6-9-11-7-4-3-5-8-11/h3-9H,10H2,1-2H3,(H,17,18)/b9-6+/f/h17H

InChIKey: InChIKey=GJSSSUBMGXKITK-HFCKROGTDO
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CC=CC3=CC=CC=C3

Names:
    NSC14321
    Theophylline, 8-cinnamyl-
    1H-Purine-2,6-dione, 3,7-dihydro-1, 3-dimethyl-8- (3-phenyl-2-propenyl)-
    74039-67-1
    8-Cinnamyl-theophylline
    8-cinnamyl-1,3-dimethyl-7H-purine-2,6-dione

Registries:
    PubChem CID 5354592
    PubChem ID 78522