basic_info |
|
| Product_Name: | 7-(2-CHLORO-BENZYL)-8-MERCAPTO-1,3-DIMETHYL-3,7-DIHYDRO-PURINE-2,6-DIONE |
| EnglishSynonyms: | 7-(2-CHLORO-BENZYL)-8-MERCAPTO-1,3-DIMETHYL-3,7-DIHYDRO-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD01784431 |
| pro_acceptors: | 6 |
| pro_donors: | 0 |
| pro_smile: | Cn1c2c(c(=O)n(c1=O)C)n(c(n2)S)Cc3ccccc3Cl |
| InChi: | InChI=1S/C14H13ClN4O2S/c1-17-11-10(12(20)18(2)14(17)21)19(13(22)16-11)7-8-5-3-4-6-9(8)15/h3-6H,7H2,1-2H3,(H,16,22) |
| InChiKey: | InChIKey=WCQAJZQREZFOLE-UHFFFAOYSA-N |
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