basic_info |
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| Product_Name: | 7-(2-CL-BENZYL)-3-ME-8-((1-ME-2-OXOPROPYL)THIO)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| CAS: | 402470-63-7 |
| EnglishSynonyms: | 7-(2-CL-BENZYL)-3-ME-8-((1-ME-2-OXOPROPYL)THIO)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD02983984 |
| pro_acceptors: | 7 |
| pro_donors: | 1 |
| pro_smile: | CC(C(=O)C)Sc1nc2c(n1Cc3ccccc3Cl)c(=O)[nH]c(=O)n2C |
| InChi: | InChI=1S/C17H17ClN4O3S/c1-9(23)10(2)26-17-19-14-13(15(24)20-16(25)21(14)3)22(17)8-11-6-4-5-7-12(11)18/h4-7,10H,8H2,1-3H3,(H,20,24,25) |
| InChiKey: | InChIKey=WRRSKRILRGRDLX-UHFFFAOYSA-N |
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