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CHEBI:93033 - 4-methylsulfonylbenzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

ChEBI IDCHEBI:93033
ChEBI Name4-methylsulfonylbenzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester
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DownloadsMolfile
FormulaC24H18N2O5S2
Net Charge0
Average Mass478.551
Monoisotopic Mass478.06571
SMILESCS(=O)(=O)c1ccc(C(=O)OCC#CCSc2nnc(-c3cccc4ccccc34)o2)cc1
InChIInChI=1S/C24H18N2O5S2/c1-33(28,29)19-13-11-18(12-14-19)23(27)30-15-4-5-16-32-24-26-25-22(31-24)21-10-6-8-17-7-2-3-9-20(17)21/h2-3,6-14H,15-16H2,1H3
InChIKeyGWQLSJMFDAAWOW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-methylsulfonylbenzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester (CHEBI:93033) is a naphthalenes (CHEBI:25477)
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