basic_info |
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| Product_Name: | 2-[[[[(4-BROMOPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-3,5-DICHLORO-BENZOIC ACID |
| CAS: | 532417-85-9 |
| EnglishSynonyms: | BENZOIC ACID, 2-[[[[(4-BROMOPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-3,5-DICHLORO- ; 2-[[[[(4-BROMOPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-3,5-DICHLORO-BENZOIC ACID |
| pro_mdlNumber: | MFCD03569808 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | c1cc(ccc1OCC(=O)NC(=S)Nc2c(cc(cc2Cl)Cl)C(=O)O)Br |
| InChi: | InChI=1S/C16H11BrCl2N2O4S/c17-8-1-3-10(4-2-8)25-7-13(22)20-16(26)21-14-11(15(23)24)5-9(18)6-12(14)19/h1-6H,7H2,(H,23,24)(H2,20,21,22,26) |
| InChiKey: | InChIKey=PTDDOFGBSBFHRY-UHFFFAOYSA-N |
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