EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:116177 - N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide

ChEBI IDCHEBI:116177
ChEBI NameN-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide
Stars
DownloadsMolfile
FormulaC23H25N5OS
Net Charge0
Average Mass419.554
Monoisotopic Mass419.17798
SMILESCc1ccc2nc(SCC(=O)Nc3cc(C(C)(C)C)nn3-c3ccccc3)nc2c1
InChIInChI=1S/C23H25N5OS/c1-15-10-11-17-18(12-15)25-22(24-17)30-14-21(29)26-20-13-19(23(2,3)4)27-28(20)16-8-6-5-7-9-16/h5-13H,14H2,1-4H3,(H,24,25)(H,26,29)
InChIKeyXDRIWAKGXCNRQY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide (CHEBI:116177) is a pyrazoles (CHEBI:26410)
N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide (CHEBI:116177) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-27633LINCS