basic_info |
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| Product_Name: | 3-[2-METHYL-4-(1,4-THIAZEPAN-4-YL)PHENYL]PROP-2-ENOIC ACID |
| EnglishSynonyms: | 3-[2-METHYL-4-(1,4-THIAZEPAN-4-YL)PHENYL]PROP-2-ENOIC ACID |
| pro_mdlNumber: | MFCD17032861 |
| pro_acceptors: | 3 |
| pro_donors: | 1 |
| pro_smile: | Cc1cc(ccc1/C=C/C(=O)O)N2CCCSCC2 |
| InChi: | InChI=1S/C15H19NO2S/c1-12-11-14(16-7-2-9-19-10-8-16)5-3-13(12)4-6-15(17)18/h3-6,11H,2,7-10H2,1H3,(H,17,18)/b6-4+ |
| InChiKey: | InChIKey=KDYMGLLWYRIICL-GQCTYLIASA-N |
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