CHEBI:125042 - 3-[4-[(1S,5R)-3-(2-fluorophenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide

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ChEBI Name 3-[4-[(1S,5R)-3-(2-fluorophenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide
ChEBI ID CHEBI:125042
Stars This entity has been manually annotated by a third party.
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Formula C26H26FN3O3S
Net Charge 0
Average Mass 479.568
Monoisotopic Mass 479.16789
InChI InChI=1S/C26H26FN3O3S/c1-29(2)26(31)20-7-5-6-19(14-20)17-10-12-18(13-11-17)25-22-15-30(16-23(25)28-22)34(32,33)24-9-4-3-8-21(24)27/h3-14,22-23,25,28H,15-16H2,1-2H3/t22-,23+,25?
InChIKey UTDLTRRKSKTVBE-HCGNOCCLSA-N
SMILES CN(C)C(=O)C1=CC=CC(=C1)C2=CC=C(C=C2)C3[C@H]4CN(C[C@@H]3N4)S(=O)(=O)C5=CC=CC=C5F
ChEBI Ontology
Outgoing 3-[4-[(1S,5R)-3-(2-fluorophenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide (CHEBI:125042) is a piperidines (CHEBI:26151)
Manual Xref Database
LSM-36504 LINCS
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