basic_info |
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| Product_Name: | BENZOIC ACID, 3-[[[[3-(3,5-DIBROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-2-METHYL- |
| CAS: | 530146-60-2 |
| EnglishSynonyms: | BENZOIC ACID, 3-[[[[3-(3,5-DIBROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-2-METHYL- |
| pro_mdlNumber: | MFCD03564701 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | Cc1c(cccc1NC(=S)NC(=O)/C=C/c2cc(cc(c2OC)Br)Br)C(=O)O |
| InChi: | InChI=1S/C19H16Br2N2O4S/c1-10-13(18(25)26)4-3-5-15(10)22-19(28)23-16(24)7-6-11-8-12(20)9-14(21)17(11)27-2/h3-9H,1-2H3,(H,25,26)(H2,22,23,24,28)/b7-6+ |
| InChiKey: | InChIKey=FJEOZAUAACAGFB-VOTSOKGWSA-N |
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