basic_info |
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| Product_Name: | 5-[(4-TERT-BUTYLPHENOXY)METHYL]-4-(2-METHYLPHENYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE |
| CAS: | 539808-73-6 |
| EnglishSynonyms: | 5-[(4-TERT-BUTYLPHENOXY)METHYL]-4-(2-METHYLPHENYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE |
| pro_mdlNumber: | MFCD05154898 |
| pro_acceptors: | 4 |
| pro_donors: | 1 |
| pro_smile: | Cc1ccccc1n2c(n[nH]c2=S)COc3ccc(cc3)C(C)(C)C |
| InChi: | InChI=1S/C20H23N3OS/c1-14-7-5-6-8-17(14)23-18(21-22-19(23)25)13-24-16-11-9-15(10-12-16)20(2,3)4/h5-12H,13H2,1-4H3,(H,22,25) |
| InChiKey: | InChIKey=HNFBXQSVJFFEPU-UHFFFAOYSA-N |
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