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Substance Name: Deleobuvir sodium [USAN]
RN: 1370023-80-5
UNII: 6X4T3L6431
InChIKey: YJADTGFGJMFOLM-KJEVSKRMSA-M

Molecular Formula

  • C34-H32-Br-N6-O3.Na

Molecular Weight

  • 675.5598
 
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Names and Synonyms

Name of Substance

  • Deleobuvir sodium [USAN]

Synonyms

  • 2-Propenoic acid, 3-(2-(1-(((2-(5-bromo-2-pyrimidinyl)-3-cyclopentyl-1-methyl-1H-indol-6-yl)carbonyl)amino)cyclobutyl)-1-methyl-1H-benzimidazol-6-yl)-, sodium salt (1:1), (2E)-
  • BI 207127 NA
  • BI-207127 NA
  • BI-207127 sodium salt
  • BI-207127Na
  • Deleobuvir sodium
  • Deleobuvir sodium [USAN]
  • Sodium (2E)-3-(2-(1-(((2-(5-bromopyrimidin-2-yl)-3-cyclopentyl-1-methyl-1H-indol-6-yl)carbonyl)amino)cyclobutyl)-1-methyl-1H-benzimidazol-6-yl)prop-2-enoate
  • UNII-6X4T3L6431

Registry Numbers

CAS Registry Number

  • 1370023-80-5

FDA UNII

  • 6X4T3L6431

System Generated Number

  • 1370023805

Molecular Formulas

Molecular Formula

  • C34-H32-Br-N6-O3.Na

Molecular Formula Fragments

  • C34-H32-Br-N6-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C34H33BrN6O3.Na/c1-40-26-17-22(10-11-24(26)29(21-6-3-4-7-21)30(40)31-36-18-23(35)19-37-31)32(44)39-34(14-5-15-34)33-38-25-12-8-20(9-13-28(42)43)16-27(25)41(33)2;/h8-13,16-19,21H,3-7,14-15H2,1-2H3,(H,39,44)(H,42,43);/q;+1/p-1/b13-9+;

InChIKey

YJADTGFGJMFOLM-KJEVSKRMSA-M

Smiles

Cn1c2cc(ccc2c(c1c3ncc(cn3)Br)C4CCCC4)C(=O)NC5(CCC5)c6nc7ccc(cc7n6C)/C=C/C(=O)[O-].[Na+]