basic_info |
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| Product_Name: | 2-CHLORO-5-[[[(1-OXOPENTYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 434309-90-7 |
| EnglishSynonyms: | 2-CHLORO-5-[[[(1-OXOPENTYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 2-CHLORO-5-[[[(1-OXOPENTYL)AMINO]THIOXOMETHYL]AMINO]- ; ZERENEX E/8014089 |
| pro_mdlNumber: | MFCD03574809 |
| pro_acceptors: | 5 |
| pro_donors: | 3 |
| pro_smile: | CCCCC(=O)NC(=S)Nc1ccc(c(c1)C(=O)O)Cl |
| InChi: | InChI=1S/C13H15ClN2O3S/c1-2-3-4-11(17)16-13(20)15-8-5-6-10(14)9(7-8)12(18)19/h5-7H,2-4H2,1H3,(H,18,19)(H2,15,16,17,20) |
| InChiKey: | InChIKey=FABBVPSFCAWZSJ-UHFFFAOYSA-N |
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