basic_info |
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| Product_Name: | 3,5-DIBROMO-2-[[[(2-CHLORO-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 530146-16-8 |
| EnglishSynonyms: | BENZOIC ACID, 3,5-DIBROMO-2-[[[(2-CHLORO-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]- ; 3,5-DIBROMO-2-[[[(2-CHLORO-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| pro_mdlNumber: | MFCD03564659 |
| pro_acceptors: | 8 |
| pro_donors: | 3 |
| pro_smile: | c1cc(c(cc1[N+](=O)[O-])Cl)C(=O)NC(=S)Nc2c(cc(cc2Br)Br)C(=O)O |
| InChi: | InChI=1S/C15H8Br2ClN3O5S/c16-6-3-9(14(23)24)12(10(17)4-6)19-15(27)20-13(22)8-2-1-7(21(25)26)5-11(8)18/h1-5H,(H,23,24)(H2,19,20,22,27) |
| InChiKey: | InChIKey=KIUKPHAHQXDNRG-UHFFFAOYSA-N |
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