EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:120945 - 4-[[[5-[(4-chlorophenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]methyl]-1H-quinolin-2-one

ChEBI IDCHEBI:120945
ChEBI Name4-[[[5-[(4-chlorophenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]methyl]-1H-quinolin-2-one
Stars
DownloadsMolfile
FormulaC19H14ClN3O3S
Net Charge0
Average Mass399.859
Monoisotopic Mass399.04444
SMILESO=c1cc(CSc2nnc(COc3ccc(Cl)cc3)o2)c2ccccc2n1
InChIInChI=1S/C19H14ClN3O3S/c20-13-5-7-14(8-6-13)25-10-18-22-23-19(26-18)27-11-12-9-17(24)21-16-4-2-1-3-15(12)16/h1-9H,10-11H2,(H,21,24)
InChIKeyGTYSYCWYTPLJTK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[[[5-[(4-chlorophenoxy)methyl]-1,3,4-oxadiazol-2-yl]thio]methyl]-1H-quinolin-2-one (CHEBI:120945) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-32388LINCS