diethyl 2-acetamido-2-[4-(7H-purin-6-ylsulfanyl)butyl]propanedioate

Molecular Formula: C18H25N5O5S


InChI: InChI=1/C18H25N5O5S/c1-4-27-16(25)18(23-12(3)24,17(26)28-5-2)8-6-7-9-29-15-13-14(20-10-19-13)21-11-22-15/h10-11H,4-9H2,1-3H3,(H,23,24)(H,19,20,21,22)/f/h19,23H

InChIKey: InChIKey=SFSSRDYVWQZPPF-BNKWAMQHCY
SMILES: CCOC(=O)C(CCCCSC1=NC=NC2=C1NC=N2)(C(=O)OCC)NC(=O)C

Names:
    diethyl 2-acetamido-2-[4-(7H-purin-6-ylsulfanyl)butyl]propanedioate

Registries:
    PubChem CID 4140591
    PubChem ID 6076524