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Substance Name: Esproquin hydrochloride [USAN]
RN: 23486-22-8
UNII: 1P9E5C9137
InChIKey: ATLSSFQKJXKSHB-UHFFFAOYSA-N

Classification Codes

  • Adrenergic
  • Adrenergic Agents
  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H21-N-O-S.Cl-H

Molecular Weight

  • 287.8528
 
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Names and Synonyms

Name of Substance

  • Esproquin hydrochloride [USAN]

Synonyms

  • 2-(3-(Ethylsulfinyl)propyl)-1,2,3,4-tetrahydroisoquinoline hydrochloride
  • Esproquin HCl
  • Esproquin hydrochloride
  • Isoquinoline, 2-(3-(ethylsulfinyl)propyl)-1,2,3,4-tetrahydro-, hydrochloride
  • NC 7197
  • NC-7197
  • NSC 84974
  • UNII-1P9E5C9137

Systematic Names

  • Isoquinoline, 1,2,3,4-tetrahydro-2-(3-(ethylsulfinyl)propyl)-, hydrochloride
  • Isoquinoline, 2-(3-(ethylsulfinyl)propyl)-1,2,3,4-tetrahydro-, hydrochloride

Registry Numbers

CAS Registry Number

  • 23486-22-8

FDA UNII

  • 1P9E5C9137

Related Registry Number

  • 37517-33-2 (Parent)

System Generated Number

  • 0023486228

Molecular Formulas

Molecular Formula

  • C14-H21-N-O-S.Cl-H

Molecular Formula Fragments

  • C14-H21-N-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H21NOS.ClH/c1-2-17(16)11-5-9-15-10-8-13-6-3-4-7-14(13)12-15;/h3-4,6-7H,2,5,8-12H2,1H3;1H

InChIKey

ATLSSFQKJXKSHB-UHFFFAOYSA-N

Smiles

CCS(=O)CCCN1CCc2ccccc2C1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 77mg/kg (77mg/kg) CARDIAC: CARDIAC OUTPUT

VASCULAR: REGIONAL OR GENERAL ARTERIOLAR OR VENOUS DILATION

VASCULAR: BP ELEVATION NOT CHARACTERIZED IN AUTONOMIC SECTION
Journal of Medicinal Chemistry. Vol. 16, Pg. 859, 1973.