basic_info |
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Product_Name: | 3-ETHYL-2-[2-(2-HYDROXYETHYL)-1-PROPENYL]-5-METHYLBENZOTHIAZOLIUM IODIDE |
EnglishSynonyms: | 3-ETHYL-2-[2-(2-HYDROXYETHYL)-1-PROPENYL]-5-METHYLBENZOTHIAZOLIUM IODIDE |
pro_mdlNumber: | MFCD09752904 |
pro_acceptors: | 2 |
pro_donors: | 1 |
pro_smile: | CC[n+]1c2cc(ccc2sc1/C=C(\C)/CCO)C.[I-] |
InChi: | InChI=1S/C15H20NOS.HI/c1-4-16-13-9-11(2)5-6-14(13)18-15(16)10-12(3)7-8-17;/h5-6,9-10,17H,4,7-8H2,1-3H3;1H/q+1;/p-1/b12-10+; |
InChiKey: | InChIKey=YJFLEIKMNNAOAY-VHPXAQPISA-M |
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