EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:107120 - N-(4-bromophenyl)-5-tert-butyl-2-methyl-4-nitro-3-pyrazolecarboxamide

ChEBI IDCHEBI:107120
ChEBI NameN-(4-bromophenyl)-5-tert-butyl-2-methyl-4-nitro-3-pyrazolecarboxamide
Stars
DownloadsMolfile
FormulaC15H17BrN4O3
Net Charge0
Average Mass381.230
Monoisotopic Mass380.04840
SMILESCn1nc(C(C)(C)C)c([N+](=O)[O-])c1C(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C15H17BrN4O3/c1-15(2,3)13-11(20(22)23)12(19(4)18-13)14(21)17-10-7-5-9(16)6-8-10/h5-8H,1-4H3,(H,17,21)
InChIKeyXLJFYJSUESXBDS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(4-bromophenyl)-5-tert-butyl-2-methyl-4-nitro-3-pyrazolecarboxamide (CHEBI:107120) is a aromatic amide (CHEBI:62733)
Manual XrefsDatabases
LSM-18474LINCS