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Substance Name: T 0632
RN: 169042-78-8
InChIKey: PBRIVVTXWCBRJY-MBDHAREBSA-N

Molecular Formula

  • C28-H22-F-N3-O5.Na

Molecular Weight

  • 526.537
 
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Names and Synonyms

Name of Substance

  • T 0632

Synonyms

  • 3-(1-(2-Fluorophenyl)-2,3-dihydro-3-((3-isoquinolinyl)carbonyl)amino-6-methoxy-2-oxo-1H-indole)propanoate
  • T-0632

Systematic Name

  • 1H-Indole-3-propanoic acid, 1-(2-fluorophenyl)-2,3-dihydro-3-((3-isoquinolinylcarbonyl)amino)-6-methoxy-2-oxo-, monosodium salt, (S)-

Registry Numbers

CAS Registry Number

  • 169042-78-8

System Generated Number

  • 0169042788

Molecular Formulas

Molecular Formula

  • C28-H22-F-N3-O5.Na

Molecular Formula Fragments

  • C28-H22-F-N3-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C29H27FN2O5.Na.H/c1-37-21-12-13-22-25(17-21)32(24-9-5-4-8-23(24)30)28(36)29(22,15-14-26(33)34)31-27(35)20-11-10-18-6-2-3-7-19(18)16-20;;/h2-9,12-13,17,20H,10-11,14-16H2,1H3,(H,31,35)(H,33,34);;/t20?,29-;;/m0../s1

InChIKey

PBRIVVTXWCBRJY-MBDHAREBSA-N

Smiles

c1cccc(c1N1c2c([C@@](NC([C@@H]3CCc4ccccc4C3)=O)(C1=O)CCC(O)=O)ccc(OC)c2)F.[Na]