CHEBI:123178 - 6-(2,3-dihydro-1,4-benzodioxin-3-yl)-3-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-(2,3-dihydro-1,4-benzodioxin-3-yl)-3-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
ChEBI ID CHEBI:123178
Stars This entity has been manually annotated by a third party.
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Formula C18H14N4O3S
Net Charge 0
Average Mass 366.396
Monoisotopic Mass 366.07866
InChI InChI=1S/C18H14N4O3S/c1-2-6-12(7-3-1)23-11-16-19-20-18-22(16)21-17(26-18)15-10-24-13-8-4-5-9-14(13)25-15/h1-9,15H,10-11H2
InChIKey VZTALPISVQFMIG-UHFFFAOYSA-N
SMILES C1C(OC2=CC=CC=C2O1)C3=NN4C(=NN=C4S3)COC5=CC=CC=C5
ChEBI Ontology
Outgoing 6-(2,3-dihydro-1,4-benzodioxin-3-yl)-3-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CHEBI:123178) is a benzodioxine (CHEBI:64096)
6-(2,3-dihydro-1,4-benzodioxin-3-yl)-3-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CHEBI:123178) is a triazolothiadiazole (CHEBI:140920)
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Last Modified
01 June 2018