basic_info |
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| Product_Name: | 5-BROMO-2-[[[[[5-(4-CHLOROPHENYL)-2-FURANYL]CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 532414-50-9 |
| EnglishSynonyms: | BENZOIC ACID, 5-BROMO-2-[[[[[5-(4-CHLOROPHENYL)-2-FURANYL]CARBONYL]AMINO]THIOXOMETHYL]AMINO]- ; 5-BROMO-2-[[[[[5-(4-CHLOROPHENYL)-2-FURANYL]CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| pro_mdlNumber: | MFCD03569641 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | c1cc(ccc1c2ccc(o2)C(=O)NC(=S)Nc3ccc(cc3C(=O)O)Br)Cl |
| InChi: | InChI=1S/C19H12BrClN2O4S/c20-11-3-6-14(13(9-11)18(25)26)22-19(28)23-17(24)16-8-7-15(27-16)10-1-4-12(21)5-2-10/h1-9H,(H,25,26)(H2,22,23,24,28) |
| InChiKey: | InChIKey=NTVAPTRWBCFVHT-UHFFFAOYSA-N |
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