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CHEBI:109405 - 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(4-fluorophenyl)sulfonylethylthio]-1H-1,2,4-triazol-5-one

ChEBI IDCHEBI:109405
ChEBI Name4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(4-fluorophenyl)sulfonylethylthio]-1H-1,2,4-triazol-5-one
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FormulaC18H16FN3O5S2
Net Charge0
Average Mass437.474
Monoisotopic Mass437.05154
SMILESO=c1nnc(SCCS(=O)(=O)c2ccc(F)cc2)n1-c1ccc2c(c1)OCCO2
InChIInChI=1S/C18H16FN3O5S2/c19-12-1-4-14(5-2-12)29(24,25)10-9-28-18-21-20-17(23)22(18)13-3-6-15-16(11-13)27-8-7-26-15/h1-6,11H,7-10H2,(H,20,23)
InChIKeyRKIYIKNRUZFVSI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(4-fluorophenyl)sulfonylethylthio]-1H-1,2,4-triazol-5-one (CHEBI:109405) is a triazoles (CHEBI:35727)
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