basic_info |
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| Product_Name: | 2-[[[[(5-BROMO-1-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID |
| CAS: | 532951-79-4 |
| EnglishSynonyms: | 2-[[[[(5-BROMO-1-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID ; BENZOIC ACID, 2-[[[[(5-BROMO-1-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO- |
| pro_mdlNumber: | MFCD03574145 |
| pro_acceptors: | 5 |
| pro_donors: | 3 |
| pro_smile: | c1cc2c(cccc2Br)c(c1)C(=O)NC(=S)Nc3ccc(cc3C(=O)O)I |
| InChi: | InChI=1S/C19H12BrIN2O3S/c20-15-6-2-3-11-12(15)4-1-5-13(11)17(24)23-19(27)22-16-8-7-10(21)9-14(16)18(25)26/h1-9H,(H,25,26)(H2,22,23,24,27) |
| InChiKey: | InChIKey=IWVUHEXVZJXSDW-UHFFFAOYSA-N |
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