Chemical Compound

SCHEMBL1699888

SCHEMBL1699888 chemical structure
Primary Record

SCHEMBL1699888

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
87279375
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)NC6CCC(CC6)NC7CC7)[N+](=O)[O-])OC8=CN=C9C(=C8)C=CN9)C
Canonical SMILES
CC1(C)CCC(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(NC5CCC(NC6CC6)CC5)c([N+](=O)[O-])c4)c(Oc4cnc5[nH]ccc5c4)c3)CC2)=C(c2ccc(Cl)cc2)C1

Names & Synonyms

  • SCHEMBL1699888
  • SCHEMBL1699890
  • CHEMBL3911961
  • CHEMBL5780096
  • CHEMBL6009977
  • SCHEMBL29657429
  • SCHEMBL31344645
  • BDBM189560
  • BDBM356740
  • BDBM559088
  • US10213433, Compound 122
  • US11369599, Compound 122
  • US9174982, 122
  • cis-4-(4-{[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-en-1-yl]methyl}piperazin-1-yl)-n-[(4-{[4-(cyclopropylamino)cyclohexyl]amino}-3-nitrophenyl)sulfonyl]-2-(1h-pyrrolo[2,3-b]pyridin-5-yloxy)benzamide
  • cis-4-(4-{[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-en-1-yl]methyl}piperazin-1-yl)-N-[(4-{[4-(cyclopropylamino)cyclohexyll]amino}-3-nitrophenyl)sulfonyll]-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzamide