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CHEBI:113078 - 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[[2-(2-pyridinyl)-1-benzimidazolyl]methyl]-1H-1,2,4-triazole-5-thione

ChEBI IDCHEBI:113078
ChEBI Name4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[[2-(2-pyridinyl)-1-benzimidazolyl]methyl]-1H-1,2,4-triazole-5-thione
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DownloadsMolfile
FormulaC23H18N6O2S
Net Charge0
Average Mass442.504
Monoisotopic Mass442.12119
SMILESS=c1nnc(Cn2c(-c3ccccn3)nc3ccccc32)n1-c1ccc2c(c1)OCCO2
InChIInChI=1S/C23H18N6O2S/c32-23-27-26-21(29(23)15-8-9-19-20(13-15)31-12-11-30-19)14-28-18-7-2-1-5-16(18)25-22(28)17-6-3-4-10-24-17/h1-10,13H,11-12,14H2,(H,27,32)
InChIKeyFALMRISDPCTNLZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[[2-(2-pyridinyl)-1-benzimidazolyl]methyl]-1H-1,2,4-triazole-5-thione (CHEBI:113078) is a triazoles (CHEBI:35727)
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