Chemical Compound

CHEMBL5960241

CHEMBL5960241 chemical structure
Primary Record

CHEMBL5960241

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
145999541
SMILES
CC1(CCC(=C(C1)C23CC(C2)(C3)C(F)F)CN4CCN(CC4)C5=CC=C(C=C5)C(=O)NS(=O)(=O)C6=CC(=C(C=C6)N[C@H](CCN7CCC(CC7)N(C)C)CSC8=CC=CC=C8)S(=O)(=O)C(F)(F)F)C
Canonical SMILES
CN(C)C1CCN(CC[C@H](CSc2ccccc2)Nc2ccc(S(=O)(=O)NC(=O)c3ccc(N4CCN(CC5=C(C67CC(C(F)F)(C6)C7)CC(C)(C)CC5)CC4)cc3)cc2S(=O)(=O)C(F)(F)F)CC1

Names & Synonyms

  • CHEMBL5960241
  • SCHEMBL22581285
  • SCHEMBL31366743
  • BDBM552942
  • BDBM555338
  • US11318134, Example 62
  • US11344546, Example 62
  • (R)-4-(4-((2-(3-(Difluoromethyl)bicyclo[1.1.1]pentan-1-yl)-4,4-dimethylcyclohex-1-en-1-yl)methyl)piperazin-1-yl)-N-((4-((4-(4-(dimethylamino)piperidin-1-yl)-1-(phenylthio)butan-2-yl)amino)-3-((trifluoromethyl)sulfonyl)phenyl)sulfonyl)benzamide
  • 4-[4-[[2-[3-(difluoromethyl)-1-bicyclo[1.1.1]pentanyl]-4,4-dimethyl-cyclohexen-1-yl]methyl]piperazin-1-yl]-N-[4-[[(1R)-3-[4-(dimethylamino)-1-piperidyl]-1-(phenylsulfanylmethyl)propyl]amino]-3-(trifluoromethylsulfonyl)phenyl]sulfonyl-benzamide