basic_info |
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| Product_Name: | 2-CHLORO-5-(([(2E)-3-(2,4-DICHLOROPHENYL)PROP-2-ENOYL]CARBAMOTHIOYL)AMINO)BENZOIC ACID |
| CAS: | 532947-57-2 |
| EnglishSynonyms: | 2-CHLORO-5-(([(2E)-3-(2,4-DICHLOROPHENYL)PROP-2-ENOYL]CARBAMOTHIOYL)AMINO)BENZOIC ACID ; BENZOIC ACID, 2-CHLORO-5-[[[[3-(2,4-DICHLOROPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]- ; 2-CHLORO-5-[[[[3-(2,4-DICHLOROPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| pro_mdlNumber: | MFCD03573791 |
| pro_acceptors: | 5 |
| pro_donors: | 3 |
| pro_smile: | c1cc(c(cc1NC(=S)NC(=O)/C=C/c2ccc(cc2Cl)Cl)C(=O)O)Cl |
| InChi: | InChI=1S/C17H11Cl3N2O3S/c18-10-3-1-9(14(20)7-10)2-6-15(23)22-17(26)21-11-4-5-13(19)12(8-11)16(24)25/h1-8H,(H,24,25)(H2,21,22,23,26)/b6-2+ |
| InChiKey: | InChIKey=PEUHTJBWHYZMKU-QHHAFSJGSA-N |
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