basic_info |
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| Product_Name: | 4-[3-(3-CHLORO-4-METHYL-BENZOYL)-THIOUREIDO]-BENZOIC ACID |
| CAS: | 532429-65-5 |
| EnglishSynonyms: | BENZOIC ACID, 4-[[[(3-CHLORO-4-METHYLBENZOYL)AMINO]THIOXOMETHYL]AMINO]- ; 4-[[[(3-CHLORO-4-METHYLBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; 4-[3-(3-CHLORO-4-METHYL-BENZOYL)-THIOUREIDO]-BENZOIC ACID ; ZERENEX E/8014926 |
| pro_mdlNumber: | MFCD03570051 |
| pro_acceptors: | 5 |
| pro_donors: | 3 |
| pro_smile: | Cc1ccc(cc1Cl)C(=O)NC(=S)Nc2ccc(cc2)C(=O)O |
| InChi: | InChI=1S/C16H13ClN2O3S/c1-9-2-3-11(8-13(9)17)14(20)19-16(23)18-12-6-4-10(5-7-12)15(21)22/h2-8H,1H3,(H,21,22)(H2,18,19,20,23) |
| InChiKey: | InChIKey=SMNFJOIZZREXRM-UHFFFAOYSA-N |
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