CHEBI:125527 - 6-[2-(2-chlorophenoxy)ethyl]-3-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

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ChEBI Name 6-[2-(2-chlorophenoxy)ethyl]-3-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
ChEBI ID CHEBI:125527
Stars This entity has been manually annotated by a third party.
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Formula C18H15ClN4O2S
Net Charge 0
Average Mass 386.857
Monoisotopic Mass 386.06042
InChI InChI=1S/C18H15ClN4O2S/c19-14-8-4-5-9-15(14)24-11-10-17-22-23-16(20-21-18(23)26-17)12-25-13-6-2-1-3-7-13/h1-9H,10-12H2
InChIKey RQWAXSNKHUTUOM-UHFFFAOYSA-N
SMILES C1=CC=C(C=C1)OCC2=NN=C3N2N=C(S3)CCOC4=CC=CC=C4Cl
ChEBI Ontology
Outgoing 6-[2-(2-chlorophenoxy)ethyl]-3-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CHEBI:125527) is a aromatic ether (CHEBI:35618)
6-[2-(2-chlorophenoxy)ethyl]-3-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CHEBI:125527) is a triazolothiadiazole (CHEBI:140920)
Manual Xref Database
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Last Modified
01 June 2018