化学标识

Rupatidine

CAS 158876-82-5 · C26H26ClN3

01化学标识

Lazychem IDLC-101263
CAS RN158876-82-5
PubChem CID133017
Molecular formulaC26H26ClN3
Molecular weight416.0 g/mol
IUPAC name13-chloro-2-[1-[(5-methyl-3-pyridinyl)methyl]piperidin-4-ylidene]-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaene
InChIKeyWUZYKBABMWJHDL-UHFFFAOYSA-N

02结构与立体化学

2D structurePubChem CID 133017
Two-dimensional chemical structure of Rupatidine, CAS 158876-82-5
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 5 rings, includes aromatic atoms, includes aliphatic carbon, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres0
Ring count5
Secondary amines0
Tertiary amines1
SMILESCC1=CC(=CN=C1)CN2CCC(=C3C4=C(CCC5=C3N=CC=C5)C=C(C=C4)Cl)CC2
InChI未列出

03印度监管状态

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

04名称与关联

原料药与母体药物

未列出

名称与关联

  • Rupatadine
  • 158876-82-5
  • Rinialer
  • Rupatadina
  • 2AE8M83G3E
  • UR-12592
  • DTXSID00166534
  • rupatadinum
  • RefChem:883977
  • DTXCID9089025
  • R06AX28
  • 13-chloro-2-(1-((5-methylpyridin-3-yl)methyl)piperidin-4-ylidene)-4-azatricyclo(9.4.0.0^(3,8))pentadeca-1(15),3(8),4,6,11,13-hexaene

杂质与相关化合物

    05来源