4-(5-((Z)-3-(4-METHOXYANILINO)-2-PROPENOYL)-4-METHYL-1,3-THIAZOL-2-YL)-1-OCTYLPYRIDINIUM BROMIDE

pro_cas
pro_cdbregno
CCD02631630
pro_formula
C27 H34 N3 O2 S . Br
pro_molWeight
544.555

basic_info

Product_Name: 4-(5-((Z)-3-(4-METHOXYANILINO)-2-PROPENOYL)-4-METHYL-1,3-THIAZOL-2-YL)-1-OCTYLPYRIDINIUM BROMIDE
EnglishSynonyms: 4-(5-((Z)-3-(4-METHOXYANILINO)-2-PROPENOYL)-4-METHYL-1,3-THIAZOL-2-YL)-1-OCTYLPYRIDINIUM BROMIDE
pro_mdlNumber: MFCD16170371
pro_acceptors: 5
pro_donors: 1
pro_smile: CCCCCCCC[n+]1ccc(cc1)c2nc(c(s2)C(=O)/C=C\Nc3ccc(cc3)OC)C.[Br-]
InChi: InChI=1S/C27H33N3O2S.BrH/c1-4-5-6-7-8-9-18-30-19-15-22(16-20-30)27-29-21(2)26(33-27)25(31)14-17-28-23-10-12-24(32-3)13-11-23;/h10-17,19-20H,4-9,18H2,1-3H3;1H
InChiKey: InChIKey=WSEWDOCCSYAOTI-UHFFFAOYSA-N

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