EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:93039 - 1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-(4-morpholinyl)-3-pyrazolecarboxamide

ChEBI IDCHEBI:93039
ChEBI Name1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-(4-morpholinyl)-3-pyrazolecarboxamide
Stars
DownloadsMolfile
FormulaC21H19Cl2IN4O2
Net Charge0
Average Mass557.219
Monoisotopic Mass555.99298
SMILESCc1c(C(=O)NN2CCOCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(I)cc1
InChIInChI=1S/C21H19Cl2IN4O2/c1-13-19(21(29)26-27-8-10-30-11-9-27)25-28(18-7-4-15(22)12-17(18)23)20(13)14-2-5-16(24)6-3-14/h2-7,12H,8-11H2,1H3,(H,26,29)
InChIKeyAJFFBPZYXRNAIC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-(4-morpholinyl)-3-pyrazolecarboxamide (CHEBI:93039) is a pyrazoles (CHEBI:26410)
1-(2,4-dichlorophenyl)-5-(4-iodophenyl)-4-methyl-N-(4-morpholinyl)-3-pyrazolecarboxamide (CHEBI:93039) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-3318LINCS