3-(7-benzyl-1,3-dimethyl-2,6-dioxo-purin-8-yl)sulfanylpropanoic acid

Molecular Formula: C17H18N4O4S


InChI: InChI=1/C17H18N4O4S/c1-19-14-13(15(24)20(2)17(19)25)21(10-11-6-4-3-5-7-11)16(18-14)26-9-8-12(22)23/h3-7H,8-10H2,1-2H3,(H,22,23)/f/h22H

InChIKey: InChIKey=MGKQQHNDKWUHLG-QWOVJGMICI
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCCC(=O)O)CC3=CC=CC=C3

Names:
    3-(7-benzyl-1,3-dimethyl-2,6-dioxo-purin-8-yl)sulfanylpropanoic acid

Registries:
    PubChem CID 980161
    PubChem ID 4829807