Chemical Compound

SCHEMBL1810291

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SCHEMBL1810291 chemical structure
Primary Record

SCHEMBL1810291

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
87294710
SMILES
CC1(CCC(=C(C1)C2=CC=C(C=C2)Cl)CN3CCN(CC3)C4=CC(=C(C=C4)C(=O)NS(=O)(=O)C5=CC(=C(C=C5)OCC6C[C@@H]7C[C@H]6[C@H]([C@H]7O)O)[N+](=O)[O-])OC8=CN=C9C(=C8)C=CN9)C
Canonical SMILES
CC1(C)CCC(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(OCC5C[C@@H]6C[C@H]5[C@@H](O)[C@H]6O)c([N+](=O)[O-])c4)c(Oc4cnc5[nH]ccc5c4)c3)CC2)=C(c2ccc(Cl)cc2)C1

Names & Synonyms

  • SCHEMBL1810291
  • CHEMBL5962890
  • SCHEMBL30313905
  • BDBM356822
  • US10213433, Compound 204
  • 4-(4-{[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-en-1-yl]methyl}piperazin-1-yl)-n-[(4-{[(1r,4r,5s,6r)-5,6-dihydroxybicyclo[2.2.1]hept-2-yl]methoxy}-3-nitrophenyl)sulfonyl]-2-(1h-pyrrolo[2,3-b]pyridin-5-yloxy)benzamide