EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:127109 - 3-[4-[(1R,5S)-6-(2-fluorophenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide

ChEBI IDCHEBI:127109
ChEBI Name3-[4-[(1R,5S)-6-(2-fluorophenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide
Stars
DownloadsMolfile
FormulaC26H26FN3O3S
Net Charge0
Average Mass479.577
Monoisotopic Mass479.16789
SMILESCN(C)C(=O)c1cccc(-c2ccc(C3[C@H]4CNC[C@@H]3N4S(=O)(=O)c3ccccc3F)cc2)c1
InChIInChI=1S/C26H26FN3O3S/c1-29(2)26(31)20-7-5-6-19(14-20)17-10-12-18(13-11-17)25-22-15-28-16-23(25)30(22)34(32,33)24-9-4-3-8-21(24)27/h3-14,22-23,25,28H,15-16H2,1-2H3/t22-,23+,25?
InChIKeyAMPIZPGJPUBYKU-HCGNOCCLSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[4-[(1R,5S)-6-(2-fluorophenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide (CHEBI:127109) is a piperidines (CHEBI:26151)
Manual XrefsDatabases
LSM-38671LINCS