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CHEBI:757680 - bi 639667

Default Structure
ChEBI IDCHEBI:757680
ChEBI Namebi 639667
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC22H18FN5O3S
Net Charge0
Average Mass451.483
Monoisotopic Mass451.11144
SMILESCS(=O)(=O)c1cc(C2(NC(=O)c3cncc4c3cnn4-c3ccc(F)cc3)CC2)ccn1
InChIInChI=1S/C22H18FN5O3S/c1-32(30,31)20-10-14(6-9-25-20)22(7-8-22)27-21(29)18-11-24-13-19-17(18)12-26-28(19)16-4-2-15(23)3-5-16/h2-6,9-13H,7-8H2,1H3,(H,27,29)
InChIKeyPXQATVYJKMMHAU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
bi 639667 (CHEBI:757680) is a pyrazoles (CHEBI:26410)
bi 639667 (CHEBI:757680) is a ring assembly (CHEBI:36820)
Synonym  Source
Bi 639667ChEMBL
Citations