basic_info |
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| Product_Name： | 8-(ACETONYLTHIO)-6-THIOTHEOPHYLLINE |
| CAS： | 6466-01-9 |
| EnglishSynonyms： | 8-(ACETONYLTHIO)-6-THIOTHEOPHYLLINE |
| pro_mdlNumber： | MFCD01682364 |
| pro_acceptors： | 6 |
| pro_donors： | 1 |
| pro_smile： | CC(=O)CSc1[nH]c2c(n1)n(c(=O)n(c2=S)C)C |
| InChi： | InChI=1S/C10H12N4O2S2/c1-5(15)4-18-9-11-6-7(12-9)13(2)10(16)14(3)8(6)17/h4H2,1-3H3,(H,11,12) |
| InChiKey： | InChIKey=BBXFGEBSYQIPGF-UHFFFAOYSA-N |
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