basic_info |
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| Product_Name: | 2-([5-[(3,4-DICHLOROANILINO)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(3-METHYLPHENYL)ACETAMIDE |
| CAS: | 539809-59-1 |
| EnglishSynonyms: | 2-([5-[(3,4-DICHLOROANILINO)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(3-METHYLPHENYL)ACETAMIDE |
| pro_mdlNumber: | MFCD03460780 |
| pro_acceptors: | 6 |
| pro_donors: | 2 |
| pro_smile: | Cc1cccc(c1)NC(=O)CSc2nnc(n2c3ccccc3)CNc4ccc(c(c4)Cl)Cl |
| InChi: | InChI=1S/C24H21Cl2N5OS/c1-16-6-5-7-18(12-16)28-23(32)15-33-24-30-29-22(31(24)19-8-3-2-4-9-19)14-27-17-10-11-20(25)21(26)13-17/h2-13,27H,14-15H2,1H3,(H,28,32) |
| InChiKey: | InChIKey=AKKLVBMELXNRAU-UHFFFAOYSA-N |
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