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CHEBI:116651 - 4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-3-hydroxy-1-cyclohexa-2,5-dienone

ChEBI IDCHEBI:116651
ChEBI Name4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-3-hydroxy-1-cyclohexa-2,5-dienone
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DownloadsMolfile
FormulaC16H13N3O4S
Net Charge0
Average Mass343.364
Monoisotopic Mass343.06268
SMILESO=C1C=CC(=C2NNC(=S)N2c2ccc3c(c2)OCCO3)C(O)=C1
InChIInChI=1S/C16H13N3O4S/c20-10-2-3-11(12(21)8-10)15-17-18-16(24)19(15)9-1-4-13-14(7-9)23-6-5-22-13/h1-4,7-8,17,21H,5-6H2,(H,18,24)
InChIKeyFVQCCWYCCXEOSE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-3-hydroxy-1-cyclohexa-2,5-dienone (CHEBI:116651) is a benzodioxine (CHEBI:64096)
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