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CHEBI:92429 - 4-chloro-3-(trifluoromethyl)benzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

ChEBI IDCHEBI:92429
ChEBI Name4-chloro-3-(trifluoromethyl)benzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester
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FormulaC24H14ClF3N2O3S
Net Charge0
Average Mass502.901
Monoisotopic Mass502.03658
SMILESO=C(OCC#CCSc1nnc(-c2cccc3ccccc23)o1)c1ccc(Cl)c(C(F)(F)F)c1
InChIInChI=1S/C24H14ClF3N2O3S/c25-20-11-10-16(14-19(20)24(26,27)28)22(31)32-12-3-4-13-34-23-30-29-21(33-23)18-9-5-7-15-6-1-2-8-17(15)18/h1-2,5-11,14H,12-13H2
InChIKeyNIOZZHKKJJBKHV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-chloro-3-(trifluoromethyl)benzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester (CHEBI:92429) is a naphthalenes (CHEBI:25477)
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