basic_info |
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| Product_Name: | 3-((((1-(ACRYLOYLAMINO)2,2,2-TRICHLOROETHYL)AMINO)CARBOTHIOYL)AMINO)BENZOIC ACID |
| EnglishSynonyms: | 3-((((1-(ACRYLOYLAMINO)2,2,2-TRICHLOROETHYL)AMINO)CARBOTHIOYL)AMINO)BENZOIC ACID |
| pro_mdlNumber: | MFCD02167251 |
| pro_acceptors: | 6 |
| pro_donors: | 4 |
| pro_smile: | C=CC(=O)NC(C(Cl)(Cl)Cl)NC(=S)Nc1cccc(c1)C(=O)O |
| InChi: | InChI=1S/C13H12Cl3N3O3S/c1-2-9(20)18-11(13(14,15)16)19-12(23)17-8-5-3-4-7(6-8)10(21)22/h2-6,11H,1H2,(H,18,20)(H,21,22)(H2,17,19,23) |
| InChiKey: | InChIKey=PQSKRDCYDLWOAX-UHFFFAOYSA-N |
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