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CHEBI:93126 - 4-fluorobenzoic acid 4-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

ChEBI IDCHEBI:93126
ChEBI Name4-fluorobenzoic acid 4-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester
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DownloadsMolfile
FormulaC19H12ClFN2O3S
Net Charge0
Average Mass402.834
Monoisotopic Mass402.02412
SMILESO=C(OCC#CCSc1nnc(-c2ccc(Cl)cc2)o1)c1ccc(F)cc1
InChIInChI=1S/C19H12ClFN2O3S/c20-15-7-3-13(4-8-15)17-22-23-19(26-17)27-12-2-1-11-25-18(24)14-5-9-16(21)10-6-14/h3-10H,11-12H2
InChIKeyFCAQXYFPTFDQEH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-fluorobenzoic acid 4-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester (CHEBI:93126) is a benzoate ester (CHEBI:36054)
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