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CHEBI:93023 - 3,4,5-trifluorobenzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

ChEBI IDCHEBI:93023
ChEBI Name3,4,5-trifluorobenzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester
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FormulaC23H13F3N2O3S
Net Charge0
Average Mass454.429
Monoisotopic Mass454.05990
SMILESO=C(OCC#CCSc1nnc(-c2cccc3ccccc23)o1)c1cc(F)c(F)c(F)c1
InChIInChI=1S/C23H13F3N2O3S/c24-18-12-15(13-19(25)20(18)26)22(29)30-10-3-4-11-32-23-28-27-21(31-23)17-9-5-7-14-6-1-2-8-16(14)17/h1-2,5-9,12-13H,10-11H2
InChIKeyREAKASMONPHWMT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3,4,5-trifluorobenzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester (CHEBI:93023) is a naphthalenes (CHEBI:25477)
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