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CHEBI:114773 - 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone

ChEBI IDCHEBI:114773
ChEBI Name1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone
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FormulaC20H18N2O4S
Net Charge0
Average Mass382.441
Monoisotopic Mass382.09873
SMILESCc1cc(C)cc(-c2nnc(SCC(=O)c3ccc4c(c3)OCCO4)o2)c1
InChIInChI=1S/C20H18N2O4S/c1-12-7-13(2)9-15(8-12)19-21-22-20(26-19)27-11-16(23)14-3-4-17-18(10-14)25-6-5-24-17/h3-4,7-10H,5-6,11H2,1-2H3
InChIKeyWRSUQPGAAXHXCS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone (CHEBI:114773) is a benzodioxine (CHEBI:64096)
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