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CHEBI:750970 - dibupyrone

Default Structure
ChEBI IDCHEBI:750970
ChEBI Namedibupyrone
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaNa.C16H22N3O4S
Net Charge0
Average Mass375.426
Monoisotopic Mass375.12287
SMILESCc1c(N(CC(C)C)CS(=O)(=O)[O-])c(=O)n(-c2ccccc2)n1C.[Na+]
InChIInChI=1S/C16H23N3O4S.Na/c1-12(2)10-18(11-24(21,22)23)15-13(3)17(4)19(16(15)20)14-8-6-5-7-9-14;/h5-9,12H,10-11H2,1-4H3,(H,21,22,23);/q;+1/p-1
InChIKeyCGTMEHPODKVIII-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
dibupyrone (CHEBI:750970) is a pyrazoles (CHEBI:26410)
dibupyrone (CHEBI:750970) is a ring assembly (CHEBI:36820)
INNs  Source
dibupironaWHO MedNet
dibupyroneWHO MedNet