basic_info |
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| Product_Name: | 2-[[[(4-CHLORO-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-3,5-DIIODO-BENZOIC ACID |
| CAS: | 532388-27-5 |
| EnglishSynonyms: | BENZOIC ACID, 2-[[[(4-CHLORO-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-3,5-DIIODO- ; 2-[[[(4-CHLORO-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-3,5-DIIODO-BENZOIC ACID |
| pro_mdlNumber: | MFCD03569484 |
| pro_acceptors: | 8 |
| pro_donors: | 3 |
| pro_smile: | c1cc(c(cc1C(=O)NC(=S)Nc2c(cc(cc2I)I)C(=O)O)[N+](=O)[O-])Cl |
| InChi: | InChI=1S/C15H8ClI2N3O5S/c16-9-2-1-6(3-11(9)21(25)26)13(22)20-15(27)19-12-8(14(23)24)4-7(17)5-10(12)18/h1-5H,(H,23,24)(H2,19,20,22,27) |
| InChiKey: | InChIKey=WTCQXFAXZQXQPB-UHFFFAOYSA-N |
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