EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:93963 - 1-(3-acetylphenyl)-3-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]urea

ChEBI IDCHEBI:93963
ChEBI Name1-(3-acetylphenyl)-3-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]urea
Stars
DownloadsMolfile
FormulaC19H15BrClFN4O2
Net Charge0
Average Mass465.710
Monoisotopic Mass464.00509
SMILESCC(=O)c1cccc(NC(=O)Nc2nn(Cc3c(F)cccc3Cl)cc2Br)c1
InChIInChI=1S/C19H15BrClFN4O2/c1-11(27)12-4-2-5-13(8-12)23-19(28)24-18-15(20)10-26(25-18)9-14-16(21)6-3-7-17(14)22/h2-8,10H,9H2,1H3,(H2,23,24,25,28)
InChIKeyFLHRFAHRPMGLLD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(3-acetylphenyl)-3-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]urea (CHEBI:93963) is a aromatic ketone (CHEBI:76224)
Manual XrefsDatabases
LSM-4546LINCS