basic_info |
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| Product_Name: | 3-[[[[(3,5-DIMETHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID |
| CAS: | 532423-72-6 |
| EnglishSynonyms: | 3-[[[[(3,5-DIMETHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID ; BENZOIC ACID, 3-[[[[(3,5-DIMETHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL- |
| pro_mdlNumber: | MFCD03568366 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | Cc1ccc(cc1NC(=S)NC(=O)COc2cc(cc(c2)C)C)C(=O)O |
| InChi: | InChI=1S/C19H20N2O4S/c1-11-6-12(2)8-15(7-11)25-10-17(22)21-19(26)20-16-9-14(18(23)24)5-4-13(16)3/h4-9H,10H2,1-3H3,(H,23,24)(H2,20,21,22,26) |
| InChiKey: | InChIKey=QGEPHWKMSKLXMX-UHFFFAOYSA-N |
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