MOLI001316

Molecular Formula: C₁₆H₁₅ClN₄O₂

InChI: InChI=1/C16H15ClN4O2/c1-19-12(8-7-10-5-4-6-11(17)9-10)18-14-13(19)15(22)21(3)16(23)20(14)2/h4-9H,1-3H3/b8-7+/i1-1

InChIKey: InChIKey=WBWFIUAVMCNYPG-NWHGENIKFU
SMILES: CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)C=CC3=CC(=CC=C3)Cl

Names:
    MOLI001316
    8-[(E)-2-(3-chlorophenyl)ethenyl]-1,3,7-trimethyl-purine-2,6-dione

Registries:
    PubChem CID 5462118
    PubChem ID 1255