basic_info |
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| Product_Name: | N-(2,6-DIBROMO-4-METHYLPHENYL)-2-[[4-ETHYL-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETAMIDE |
| CAS: | 585563-26-4 |
| EnglishSynonyms: | N-(2,6-DIBROMO-4-METHYLPHENYL)-2-[[4-ETHYL-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETAMIDE |
| pro_mdlNumber: | MFCD04030813 |
| pro_acceptors: | 6 |
| pro_donors: | 1 |
| pro_smile: | CCn1c(nnc1SCC(=O)Nc2c(cc(cc2Br)C)Br)c3cccnc3 |
| InChi: | InChI=1S/C18H17Br2N5OS/c1-3-25-17(12-5-4-6-21-9-12)23-24-18(25)27-10-15(26)22-16-13(19)7-11(2)8-14(16)20/h4-9H,3,10H2,1-2H3,(H,22,26) |
| InChiKey: | InChIKey=JJTZJAVNFGYODC-UHFFFAOYSA-N |
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