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Substance Name: Lupitidine hydrochloride [USAN]
RN: 72716-75-7
UNII: XKU5YY749W
InChIKey: YMVSCUJJVSENIP-UHFFFAOYSA-N

Note

  • Inhibits nocturnal acid secretion.

Molecular Formula

  • C21-H27-N5-O2-S.3Cl-H

Molecular Weight

  • 522.926
 

Classification Codes

  • Antagonist
  • Antagonist (to Histamine H2 Receptors, Veterinary)
  • Histamine Agents
  • Histamine Antagonists
  • Histamine H2 Antagonists
  • Neurotransmitter Agents
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Names and Synonyms

Name of Substance

  • Lupitidine hydrochloride [USAN]
  • SK&F 93479

Synonyms

  • 2-((2-((5-((Dimethylamino)methyl)furfuryl)thio)ethyl)amino)-5-((6-methyl-3-pyridyl)methyl)-4-(1H)-pyrimidinone trihydrochloride
  • 4(1H)-Pyrimidinone, 2-((2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)amino)-5-((6-methyl-3-pyridinyl)methyl)-, trihydrochloride
  • Lupitidine HCl
  • Lupitidine hydrochloride
  • SK&F 93479
  • UNII-XKU5YY749W

Systematic Name

  • 4(1H)-Pyrimidinone, 2-((2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)amino)-5-((6-methyl-3-pyridinyl)methyl)-, trihydrochloride

Registry Numbers

CAS Registry Number

  • 72716-75-7

FDA UNII

  • XKU5YY749W

System Generated Number

  • 0072716757

Molecular Formulas

Molecular Formula

  • C21-H27-N5-O2-S.3Cl-H

Molecular Formula Fragments

  • C21-H27-N5-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H27N5O2S.3ClH/c1-15-4-5-16(11-23-15)10-17-12-24-21(25-20(17)27)22-8-9-29-14-19-7-6-18(28-19)13-26(2)3;;;/h4-7,11-12H,8-10,13-14H2,1-3H3,(H2,22,24,25,27);3*1H

InChIKey

YMVSCUJJVSENIP-UHFFFAOYSA-N

Smiles

Cl.Cl.Cl.CN(C)Cc1oc(CSCCNC2=NC(=O)C(=CN2)Cc3ccc(C)nc3)cc1