basic_info |
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| Product_Name: | 2-[[[[(4-CHLORO-2-METHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-3,5-DIIODO-BENZOIC ACID |
| CAS: | 531515-83-0 |
| EnglishSynonyms: | BENZOIC ACID, 2-[[[[(4-CHLORO-2-METHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-3,5-DIIODO- ; 2-[[[[(4-CHLORO-2-METHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-3,5-DIIODO-BENZOIC ACID |
| pro_mdlNumber: | MFCD03565520 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | Cc1cc(ccc1OCC(=O)NC(=S)Nc2c(cc(cc2I)I)C(=O)O)Cl |
| InChi: | InChI=1S/C17H13ClI2N2O4S/c1-8-4-9(18)2-3-13(8)26-7-14(23)21-17(27)22-15-11(16(24)25)5-10(19)6-12(15)20/h2-6H,7H2,1H3,(H,24,25)(H2,21,22,23,27) |
| InChiKey: | InChIKey=KNCDIEHMDXYDDZ-UHFFFAOYSA-N |
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