basic_info |
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| Product_Name: | 2-[[[(3,5-DIBROMO-2-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 530138-44-4 |
| EnglishSynonyms: | BENZOIC ACID, 2-[[[(3,5-DIBROMO-2-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]- ; 2-[[[(3,5-DIBROMO-2-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| pro_mdlNumber: | MFCD03564357 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | COc1c(cc(cc1Br)Br)C(=O)NC(=S)Nc2ccccc2C(=O)O |
| InChi: | InChI=1S/C16H12Br2N2O4S/c1-24-13-10(6-8(17)7-11(13)18)14(21)20-16(25)19-12-5-3-2-4-9(12)15(22)23/h2-7H,1H3,(H,22,23)(H2,19,20,21,25) |
| InChiKey: | InChIKey=LXCWVINUNNHVAW-UHFFFAOYSA-N |
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