basic_info |
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| Product_Name: | 7-(2-BUTENYL)-8-((2-CL-6-FLUOROBENZYL)THIO)-3-ME-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| EnglishSynonyms: | 7-(2-BUTENYL)-8-((2-CL-6-FLUOROBENZYL)THIO)-3-ME-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD02984462 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | C/C=C/Cn1c2c(=O)[nH]c(=O)n(c2nc1SCc3c(cccc3Cl)F)C |
| InChi: | InChI=1S/C17H16ClFN4O2S/c1-3-4-8-23-13-14(22(2)16(25)21-15(13)24)20-17(23)26-9-10-11(18)6-5-7-12(10)19/h3-7H,8-9H2,1-2H3,(H,21,24,25)/b4-3+ |
| InChiKey: | InChIKey=ACVMBHWVPTXQAD-ONEGZZNKSA-N |
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