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CHEBI:125031 - 3-[4-[(1S,5R)-3-(3-chlorophenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide

ChEBI IDCHEBI:125031
ChEBI Name3-[4-[(1S,5R)-3-(3-chlorophenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide
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DownloadsMolfile
FormulaC26H26ClN3O3S
Net Charge0
Average Mass496.032
Monoisotopic Mass495.13834
SMILESCN(C)C(=O)c1cccc(-c2ccc(C3[C@@H]4CN(S(=O)(=O)c5cccc(Cl)c5)C[C@H]3N4)cc2)c1
InChIInChI=1S/C26H26ClN3O3S/c1-29(2)26(31)20-6-3-5-19(13-20)17-9-11-18(12-10-17)25-23-15-30(16-24(25)28-23)34(32,33)22-8-4-7-21(27)14-22/h3-14,23-25,28H,15-16H2,1-2H3/t23-,24+,25?
InChIKeyJZIACXOUJWQWLN-XMGLRAKGSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[4-[(1S,5R)-3-(3-chlorophenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide (CHEBI:125031) is a piperidines (CHEBI:26151)
Manual XrefsDatabases
LSM-36493LINCS