3-[7-[(E)-3-chlorobut-2-enyl]-3-methyl-2,6-dioxo-purin-8-yl]sulfanylpropanoic acid

Molecular Formula: C13H15ClN4O4S


InChI: InChI=1/C13H15ClN4O4S/c1-7(14)3-5-18-9-10(17(2)12(22)16-11(9)21)15-13(18)23-6-4-8(19)20/h3H,4-6H2,1-2H3,(H,19,20)(H,16,21,22)/b7-3+/f/h16,19H

InChIKey: InChIKey=FZJWUVABOZTKCC-MCCPAEBRDM
SMILES: CC(=CCN1C2=C(N=C1SCCC(=O)O)N(C(=O)NC2=O)C)Cl

Names:
    3-[7-[(E)-3-chlorobut-2-enyl]-3-methyl-2,6-dioxo-purin-8-yl]sulfanylpropanoic acid

Registries:
    PubChem CID 6341934
    PubChem ID 11600939