EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:114981 - [4-(benzenesulfonyl)-1-piperazinyl]-[6-bromo-2-(2-pyridinyl)-4-quinolinyl]methanone

ChEBI IDCHEBI:114981
ChEBI Name[4-(benzenesulfonyl)-1-piperazinyl]-[6-bromo-2-(2-pyridinyl)-4-quinolinyl]methanone
Stars
DownloadsMolfile
FormulaC25H21BrN4O3S
Net Charge0
Average Mass537.439
Monoisotopic Mass536.05177
SMILESO=C(c1cc(-c2ccccn2)nc2ccc(Br)cc12)N1CCN(S(=O)(=O)c2ccccc2)CC1
InChIInChI=1S/C25H21BrN4O3S/c26-18-9-10-22-20(16-18)21(17-24(28-22)23-8-4-5-11-27-23)25(31)29-12-14-30(15-13-29)34(32,33)19-6-2-1-3-7-19/h1-11,16-17H,12-15H2
InChIKeyZQPCEFWSXOJISA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
[4-(benzenesulfonyl)-1-piperazinyl]-[6-bromo-2-(2-pyridinyl)-4-quinolinyl]methanone (CHEBI:114981) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-26443LINCS