basic_info |
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| Product_Name: | 2-BR-4-(((3-(2-CL-PH)-5-MERCAPTO-4H-1,2,4-TRIAZOL-4-YL)IMINO)ME)-6-METHOXYPHENOL |
| CAS: | 478254-34-1 |
| EnglishSynonyms: | 2-BR-4-(((3-(2-CL-PH)-5-MERCAPTO-4H-1,2,4-TRIAZOL-4-YL)IMINO)ME)-6-METHOXYPHENOL |
| pro_mdlNumber: | MFCD03673243 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | COc1cc(cc(c1O)Br)/C=N/n2c(nnc2S)c3ccccc3Cl |
| InChi: | InChI=1S/C16H12BrClN4O2S/c1-24-13-7-9(6-11(17)14(13)23)8-19-22-15(20-21-16(22)25)10-4-2-3-5-12(10)18/h2-8,23H,1H3,(H,21,25)/b19-8+ |
| InChiKey: | InChIKey=UNTCWCJDADVZLB-UFWORHAWSA-N |
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