basic_info |
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| Product_Name: | 7-(3-CHLORO-BENZYL)-8-MERCAPTO-3-METHYL-3,7-DIHYDRO-PURINE-2,6-DIONE |
| EnglishSynonyms: | 7-(3-CHLORO-BENZYL)-8-MERCAPTO-3-METHYL-3,7-DIHYDRO-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD18785257 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | Cn1c2c(c(=O)[nH]c1=O)n(c(n2)S)Cc3cccc(c3)Cl |
| InChi: | InChI=1S/C13H11ClN4O2S/c1-17-10-9(11(19)16-12(17)20)18(13(21)15-10)6-7-3-2-4-8(14)5-7/h2-5H,6H2,1H3,(H,15,21)(H,16,19,20) |
| InChiKey: | InChIKey=FCOWNMLTFXATJR-UHFFFAOYSA-N |
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