basic_info |
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| Product_Name: | 2-ALLYL-6-(((3-(4-F-PH)-5-MERCAPTO-4H-1,2,4-TRIAZOL-4-YL)IMINO)METHYL)PHENOL |
| CAS: | 578722-44-8 |
| EnglishSynonyms: | 2-ALLYL-6-(((3-(4-F-PH)-5-MERCAPTO-4H-1,2,4-TRIAZOL-4-YL)IMINO)METHYL)PHENOL |
| pro_mdlNumber: | MFCD04029777 |
| pro_acceptors: | 5 |
| pro_donors: | 1 |
| pro_smile: | C=CCc1cccc(c1O)/C=N/n2c(nnc2S)c3ccc(cc3)F |
| InChi: | InChI=1S/C18H15FN4OS/c1-2-4-12-5-3-6-14(16(12)24)11-20-23-17(21-22-18(23)25)13-7-9-15(19)10-8-13/h2-3,5-11,24H,1,4H2,(H,22,25)/b20-11+ |
| InChiKey: | InChIKey=HDFFVKRDGYAKET-RGVLZGJSSA-N |
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