basic_info |
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| Product_Name: | 8-[(3-CHLORO-2-HYDROXYPROPYL)SULFANYL]-3-METHYL-7-(2-METHYL-2-PROPENYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| CAS: | 477333-68-9 |
| EnglishSynonyms: | 8-[(3-CHLORO-2-HYDROXYPROPYL)SULFANYL]-3-METHYL-7-(2-METHYL-2-PROPENYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD02223116 |
| pro_acceptors: | 7 |
| pro_donors: | 2 |
| pro_smile: | CC(=C)Cn1c2c(=O)[nH]c(=O)n(c2nc1SCC(CCl)O)C |
| InChi: | InChI=1S/C13H17ClN4O3S/c1-7(2)5-18-9-10(17(3)12(21)16-11(9)20)15-13(18)22-6-8(19)4-14/h8,19H,1,4-6H2,2-3H3,(H,16,20,21) |
| InChiKey: | InChIKey=GIMXQILHESXGJU-UHFFFAOYSA-N |
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