basic_info |
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| Product_Name: | 4-[[[[(2,4-DICHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 531520-64-6 |
| EnglishSynonyms: | 4-[[[[(2,4-DICHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 4-[[[[(2,4-DICHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]- |
| pro_mdlNumber: | MFCD03565837 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | c1cc(ccc1C(=O)O)NC(=S)NC(=O)COc2ccc(cc2Cl)Cl |
| InChi: | InChI=1S/C16H12Cl2N2O4S/c17-10-3-6-13(12(18)7-10)24-8-14(21)20-16(25)19-11-4-1-9(2-5-11)15(22)23/h1-7H,8H2,(H,22,23)(H2,19,20,21,25) |
| InChiKey: | InChIKey=FXMWIRKBHRZXKF-UHFFFAOYSA-N |
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