basic_info |
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| Product_Name: | 5-BROMO-2-[[[[(4-CHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 535936-89-1 |
| EnglishSynonyms: | BENZOIC ACID, 5-BROMO-2-[[[[(4-CHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]- ; 5-BROMO-2-[[[[(4-CHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| pro_mdlNumber: | MFCD03571313 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | c1cc(ccc1OCC(=O)NC(=S)Nc2ccc(cc2C(=O)O)Br)Cl |
| InChi: | InChI=1S/C16H12BrClN2O4S/c17-9-1-6-13(12(7-9)15(22)23)19-16(25)20-14(21)8-24-11-4-2-10(18)3-5-11/h1-7H,8H2,(H,22,23)(H2,19,20,21,25) |
| InChiKey: | InChIKey=QOVQBGKDBXZXTM-UHFFFAOYSA-N |
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