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CHEBI:92458 - 4-fluorobenzoic acid 4-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

ChEBI IDCHEBI:92458
ChEBI Name4-fluorobenzoic acid 4-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester
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FormulaC20H15FN2O4S
Net Charge0
Average Mass398.415
Monoisotopic Mass398.07366
SMILESCOc1ccccc1-c1nnc(SCC#CCOC(=O)c2ccc(F)cc2)o1
InChIInChI=1S/C20H15FN2O4S/c1-25-17-7-3-2-6-16(17)18-22-23-20(27-18)28-13-5-4-12-26-19(24)14-8-10-15(21)11-9-14/h2-3,6-11H,12-13H2,1H3
InChIKeyKRODTTQINRPALR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-fluorobenzoic acid 4-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester (CHEBI:92458) is a benzoate ester (CHEBI:36054)
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