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Substance Name: Mesulergine hydrochloride
RN: 72786-12-0
InChIKey: HANSYUJEPWNHIM-IVMONYBCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H26-N4-O2-S.Cl-H

Molecular Weight

  • 398.956
 
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Names and Synonyms

Results Name

  • Mesulergine hydrochloride

Synonyms

  • CU 32-085
  • Mesulergine HCl
  • Mesulergine hydrochloride
  • N'-((8-alpha)-1,6-Dimethylergolin-8-yl)-N,N-dimethylsulfamide monohydrochloride
  • N-(1,6-Dimethylergolin-8-alpha-yl)-N,N-dimethylsulfamide hydrochloride

Systematic Names

  • Sulfamide, N'-((8-alpha)-1,6-dimethylergolin-8-yl)-N,N-dimethyl-, monohydrochloride
  • Sulfamide, N'-((8alpha)-1,6-dimethylergolin-8-yl)-N,N-dimethyl-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 72786-12-0

Related Registry Number

  • 64795-35-3 (Parent)

System Generated Number

  • 0072786120

Molecular Formulas

Molecular Formula

  • C18-H26-N4-O2-S.Cl-H

Molecular Formula Fragments

  • C18-H26-N4-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H26N4O2S.ClH/c1-20(2)25(23,24)19-13-9-15-14-6-5-7-16-18(14)12(10-21(16)3)8-17(15)22(4)11-13;/h5-7,10,13,15,17,19H,8-9,11H2,1-4H3;1H/t13-,15+,17+;/m0./s1

InChIKey

HANSYUJEPWNHIM-IVMONYBCSA-N

Smiles

c12cccc3c1c(C[C@@H]1[C@@H]3C[C@H](NS(N(C)C)(=O)=O)C[N@@]1C)cn2C.Cl