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Substance Name: Cilansetron Hydrochloride [USAN]
RN: 209859-87-0
UNII: 40JL785VD0
InChIKey: JXQUEAGLZNCBHC-QCUBGVIVSA-N

Note

  • Binds to 5-HT(3) receptors.

Classification Code

  • Treatment of Irritable Bowel Syndrome (IBS) with Diarrhea Predominance

Molecular Formula

  • C20-H21-N3-O.Cl-H-H2-O

Molecular Weight

  • 373.8816
 
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Names and Synonyms

Name of Substance

  • Cilansetron Hydrochloride [USAN]

Synonyms

  • (10R)-5,6,9,10-Tetrahydro-10((2-methylimidazol-1-yl)methyl)-4H-pyrido(3,2,1-jk)carbazol-11(8H)-one monohydrochloride, monohydrate
  • 4H-Pyrido(3,2,1-jk) carbazol-11-(8H)-one, 5,6,9,10-tetrahydro-10-((2-methyl-1H-imidazol-1-yl) methyl)-, monohydrochloride monohydrate (10R)-
  • Cilansetron Hydrochloride
  • DU123265
  • KC-9946
  • MIM-6PCAB-11 HCl
  • UNII-40JL785VD0

Registry Numbers

CAS Registry Number

  • 209859-87-0

FDA UNII

  • 40JL785VD0

System Generated Number

  • 0209859870

Molecular Formulas

Molecular Formula

  • C20-H21-N3-O.Cl-H-H2-O

Molecular Formula Fragments

  • C20-H21-N3-O
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C20H21N3O.ClH.H2O/c1-13-21-9-11-22(13)12-15-7-8-17-18(20(15)24)16-6-2-4-14-5-3-10-23(17)19(14)16;;/h2,4,6,9,11,15H,3,5,7-8,10,12H2,1H3;1H;1H2/t15-;;/m1../s1

InChIKey

JXQUEAGLZNCBHC-QCUBGVIVSA-N

Smiles

Cc1nccn1C[C@H]2CCc3c(c4cccc5c4n3CCC5)C2=O.O.Cl