basic_info |
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| Product_Name: | 3-[[[[(4-BROMOPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 462612-73-3 |
| EnglishSynonyms: | 3-[[[[(4-BROMOPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 3-[[[[(4-BROMOPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]- |
| pro_mdlNumber: | MFCD03243334 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | c1cc(cc(c1)NC(=S)NC(=O)COc2ccc(cc2)Br)C(=O)O |
| InChi: | InChI=1S/C16H13BrN2O4S/c17-11-4-6-13(7-5-11)23-9-14(20)19-16(24)18-12-3-1-2-10(8-12)15(21)22/h1-8H,9H2,(H,21,22)(H2,18,19,20,24) |
| InChiKey: | InChIKey=SYUYQTHDMVUIFV-UHFFFAOYSA-N |
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