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CHEBI:756794 - jnj-42165279

Default Structure
ChEBI IDCHEBI:756794
ChEBI Namejnj-42165279
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC18H17ClF2N4O3
Net Charge0
Average Mass410.808
Monoisotopic Mass410.09572
SMILESO=C(Nc1cnccc1Cl)N1CCN(Cc2ccc3c(c2)OC(F)(F)O3)CC1
InChIInChI=1S/C18H17ClF2N4O3/c19-13-3-4-22-10-14(13)23-17(26)25-7-5-24(6-8-25)11-12-1-2-15-16(9-12)28-18(20,21)27-15/h1-4,9-10H,5-8,11H2,(H,23,26)
InChIKeyYWGYNGCRVZLMCS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
jnj-42165279 (CHEBI:756794) is a benzodioxoles (CHEBI:38298)
Synonym  Source
Jnj-42165279ChEMBL