basic_info |
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| Product_Name: | 5-[3-(5-BROMO-NAPHTHALENE-1-CARBONYL)-THIOUREIDO]-2-CHLORO-BENZOIC ACID |
| CAS: | 535945-34-7 |
| EnglishSynonyms: | BENZOIC ACID, 5-[[[[(5-BROMO-1-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-2-CHLORO- ; 5-[[[[(5-BROMO-1-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-2-CHLORO-BENZOIC ACID ; 5-[3-(5-BROMO-NAPHTHALENE-1-CARBONYL)-THIOUREIDO]-2-CHLORO-BENZOIC ACID |
| pro_mdlNumber: | MFCD03571781 |
| pro_acceptors: | 5 |
| pro_donors: | 3 |
| pro_smile: | c1cc2c(cccc2Br)c(c1)C(=O)NC(=S)Nc3ccc(c(c3)C(=O)O)Cl |
| InChi: | InChI=1S/C19H12BrClN2O3S/c20-15-6-2-3-11-12(15)4-1-5-13(11)17(24)23-19(27)22-10-7-8-16(21)14(9-10)18(25)26/h1-9H,(H,25,26)(H2,22,23,24,27) |
| InChiKey: | InChIKey=ANYYKQKQBSELPQ-UHFFFAOYSA-N |
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