basic_info |
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| Product_Name: | 2-[[[[(2,4-DIBROMO-6-METHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-3,5-DIIODO-BENZOIC ACID |
| CAS: | 531527-31-8 |
| EnglishSynonyms: | BENZOIC ACID, 2-[[[[(2,4-DIBROMO-6-METHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-3,5-DIIODO- ; 2-[[[[(2,4-DIBROMO-6-METHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-3,5-DIIODO-BENZOIC ACID |
| pro_mdlNumber: | MFCD03565909 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | Cc1cc(cc(c1OCC(=O)NC(=S)Nc2c(cc(cc2I)I)C(=O)O)Br)Br |
| InChi: | InChI=1S/C17H12Br2I2N2O4S/c1-7-2-8(18)3-11(19)15(7)27-6-13(24)22-17(28)23-14-10(16(25)26)4-9(20)5-12(14)21/h2-5H,6H2,1H3,(H,25,26)(H2,22,23,24,28) |
| InChiKey: | InChIKey=ZYJBPNXSXXUIJV-UHFFFAOYSA-N |
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