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CHEBI:109571 - N-(1,3-benzodioxol-5-yl)-2-[[4-(4-methylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]acetamide

ChEBI IDCHEBI:109571
ChEBI NameN-(1,3-benzodioxol-5-yl)-2-[[4-(4-methylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]acetamide
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FormulaC22H18N4O3S2
Net Charge0
Average Mass450.545
Monoisotopic Mass450.08203
SMILESCc1ccc(-n2c(SCC(=O)Nc3ccc4c(c3)OCO4)nnc2-c2cccs2)cc1
InChIInChI=1S/C22H18N4O3S2/c1-14-4-7-16(8-5-14)26-21(19-3-2-10-30-19)24-25-22(26)31-12-20(27)23-15-6-9-17-18(11-15)29-13-28-17/h2-11H,12-13H2,1H3,(H,23,27)
InChIKeyQBTGMKJIHVEGEW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(1,3-benzodioxol-5-yl)-2-[[4-(4-methylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]acetamide (CHEBI:109571) is a triazoles (CHEBI:35727)
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