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CHEBI:755342 - bi 653048

Default Structure
ChEBI IDCHEBI:755342
ChEBI Namebi 653048
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC23H25F4N3O4S
Net Charge0
Average Mass515.529
Monoisotopic Mass515.15019
SMILESCCS(=O)(=O)c1cc2cc(C[C@](O)(CC(C)(C)c3ccc(F)cc3C(N)=O)C(F)(F)F)nc2cn1
InChIInChI=1S/C23H25F4N3O4S/c1-4-35(33,34)19-8-13-7-15(30-18(13)11-29-19)10-22(32,23(25,26)27)12-21(2,3)17-6-5-14(24)9-16(17)20(28)31/h5-9,11,30,32H,4,10,12H2,1-3H3,(H2,28,31)/t22-/m0/s1
InChIKeyAUIFRJWXYUNPPV-QFIPXVFZSA-N
ChEBI Ontology
Outgoing Relation(s)
bi 653048 (CHEBI:755342) is a carbonyl compound (CHEBI:36586)
bi 653048 (CHEBI:755342) is a organohalogen compound (CHEBI:17792)
Synonym  Source
Bi 653048ChEMBL
Citations