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CHEBI:93204 - 2-benzofurancarboxylic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

ChEBI IDCHEBI:93204
ChEBI Name2-benzofurancarboxylic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester
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FormulaC25H16N2O4S
Net Charge0
Average Mass440.480
Monoisotopic Mass440.08308
SMILESO=C(OCC#CCSc1nnc(-c2cccc3ccccc23)o1)c1cc2ccccc2o1
InChIInChI=1S/C25H16N2O4S/c28-24(22-16-18-9-2-4-13-21(18)30-22)29-14-5-6-15-32-25-27-26-23(31-25)20-12-7-10-17-8-1-3-11-19(17)20/h1-4,7-13,16H,14-15H2
InChIKeyZJCRSXLZUQPWCS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-benzofurancarboxylic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester (CHEBI:93204) is a naphthalenes (CHEBI:25477)
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