basic_info |
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| Product_Name: | 3,5-DIBROMO-2-[[[[4-(PHENOXYMETHYL)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 532431-31-5 |
| EnglishSynonyms: | 3,5-DIBROMO-2-[[[[4-(PHENOXYMETHYL)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 3,5-DIBROMO-2-[[[[4-(PHENOXYMETHYL)BENZOYL]AMINO]THIOXOMETHYL]AMINO]- |
| pro_mdlNumber: | MFCD03570186 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | c1ccc(cc1)OCc2ccc(cc2)C(=O)NC(=S)Nc3c(cc(cc3Br)Br)C(=O)O |
| InChi: | InChI=1S/C22H16Br2N2O4S/c23-15-10-17(21(28)29)19(18(24)11-15)25-22(31)26-20(27)14-8-6-13(7-9-14)12-30-16-4-2-1-3-5-16/h1-11H,12H2,(H,28,29)(H2,25,26,27,31) |
| InChiKey: | InChIKey=GTXUYGHHZPDCGI-UHFFFAOYSA-N |
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