EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:116139 - LSM-27595

ChEBI IDCHEBI:116139
ChEBI NameLSM-27595
Stars
DownloadsMolfile
FormulaC24H20N4O4S
Net Charge0
Average Mass460.515
Monoisotopic Mass460.12053
SMILESCOc1cccc(C(=O)CC=Nc2ccc(S(=O)(=O)Nc3cnc4ccccc4n3)cc2)c1
InChIInChI=1S/C24H20N4O4S/c1-32-19-6-4-5-17(15-19)23(29)13-14-25-18-9-11-20(12-10-18)33(30,31)28-24-16-26-21-7-2-3-8-22(21)27-24/h2-12,14-16H,13H2,1H3,(H,27,28)
InChIKeyXTIYLNTXJFRJPN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-27595 (CHEBI:116139) is a aromatic ketone (CHEBI:76224)
Manual XrefsDatabases
LSM-27595LINCS