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Substance Name: Xemilofiban hydrochloride [USAN]
RN: 156586-91-3
UNII: HIU55WBI80
InChIKey: JTZJXWLQRZUDFJ-BTQNPOSSSA-N

Classification Codes

  • Prevention of Post-Recanalization Reocclusion of Coronary Vessels
  • Treatment of Unstable Angina

Molecular Formula

  • C18-H22-N4-O4.Cl-H

Molecular Weight

  • 394.8567
 
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Names and Synonyms

Name of Substance

  • Xemilofiban hydrochloride [USAN]

Synonyms

  • 4-Pentynoic acid, 3-((4-((4-(aminoiminomethyl)phenyl)amino)-1,4-dioxobutyl)amino)-, ethyl ester, monohydrochloride, (S)-
  • Ethyl (3S)-3-(3-((p-amidinophenyl)carbamoyl)propionamido)-4-pentynoate, monohydrochloride
  • Ethyl (S)-3-(3-((p-amidinophenyl)carbamoyl)propionamido)-4-pentynoate monohydrochloride
  • SC 54684A
  • SC-54684A
  • UNII-HIU55WBI80
  • Xemilofiban HCl
  • Xemilofiban hydrochloride

Systematic Name

  • Pentynoic acid, 3-((4-((4-(aminoiminomethyl)phenyl)amino)-1,4-dioxobutyl)amino)-, ethyl ester, monohydrochloride, (S)-

Registry Numbers

CAS Registry Number

  • 156586-91-3

FDA UNII

  • HIU55WBI80

System Generated Number

  • 0156586913

Molecular Formulas

Molecular Formula

  • C18-H22-N4-O4.Cl-H

Molecular Formula Fragments

  • C18-H22-N4-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H22N4O4.ClH/c1-3-13(11-17(25)26-4-2)21-15(23)9-10-16(24)22-14-7-5-12(6-8-14)18(19)20;/h1,5-8,13H,4,9-11H2,2H3,(H3,19,20)(H,21,23)(H,22,24);1H/t13-;/m1./s1

InChIKey

JTZJXWLQRZUDFJ-BTQNPOSSSA-N

Smiles

CCOC(=O)C[C@@H](C#C)NC(=O)CCC(=O)Nc1ccc(cc1)C(=N)N.Cl