EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:92161 - 2-[5-[(5,7-dimethyl-1-oxo-2-thiazolo[3,2-a]benzimidazolylidene)methyl]-2-furanyl]benzoic acid

ChEBI IDCHEBI:92161
ChEBI Name2-[5-[(5,7-dimethyl-1-oxo-2-thiazolo[3,2-a]benzimidazolylidene)methyl]-2-furanyl]benzoic acid
Stars
DownloadsMolfile
FormulaC23H16N2O4S
Net Charge0
Average Mass416.458
Monoisotopic Mass416.08308
SMILESCc1cc(C)c2nc3sc(=Cc4ccc(-c5ccccc5C(=O)O)o4)c(=O)n3c2c1
InChIInChI=1S/C23H16N2O4S/c1-12-9-13(2)20-17(10-12)25-21(26)19(30-23(25)24-20)11-14-7-8-18(29-14)15-5-3-4-6-16(15)22(27)28/h3-11H,1-2H3,(H,27,28)
InChIKeyJFRYLPFKWKOMBZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[5-[(5,7-dimethyl-1-oxo-2-thiazolo[3,2-a]benzimidazolylidene)methyl]-2-furanyl]benzoic acid (CHEBI:92161) is a benzimidazoles (CHEBI:22715)
Manual XrefsDatabases
LSM-2185LINCS