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Substance Name: Mdl 100240
RN: 142695-08-7
UNII: 0K57643Y3A
InChIKey: AIEZUMPHACQOGT-BJESRGMDSA-N

Note

  • A prodrug of MDL 100173; MDL 100142 is the (R)-isomer; MDL 100240 is the (S)-isomer.

Molecular Formula

  • C26-H28-N2-O5-S

Molecular Weight

  • 480.582
 

Classification Codes

  • Angiotensin-Converting Enzyme Inhibitors
  • Enzyme Inhibitors
  • Protease Inhibitors
  • Vasopeptidase Inhibitors
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Names and Synonyms

Name of Substance

  • Mdl 100240

Synonyms

  • Mdl 100,142
  • Mdl 100,240
  • UNII-0K57643Y3A

Systematic Name

  • Pyrido(2,1-a)(2)benzazepine-4-carboxylic acid, 7-((2-(acetylthio)-1-oxo-3-phenylpropyl)amino)-1,2,3,4,6,7,8,12b-octahydro-6-oxo-, (4S-(4alph,7alpha(R*),12bbeta))-

Registry Numbers

CAS Registry Number

  • 142695-08-7

FDA UNII

  • 0K57643Y3A

System Generated Number

  • 0142695087

Structure Descriptors

InChI

1S/C26H28N2O5S/c1-16(29)34-23(14-17-8-3-2-4-9-17)24(30)27-20-15-18-10-5-6-11-19(18)21-12-7-13-22(26(32)33)28(21)25(20)31/h2-6,8-11,20-23H,7,12-15H2,1H3,(H,27,30)(H,32,33)/t20-,21+,22-,23-/m0/s1

InChIKey

AIEZUMPHACQOGT-BJESRGMDSA-N

Smiles

N12C([C@H](Cc3c([C@H]1CCC[C@H]2C(=O)O)cccc3)NC([C@H](Cc1ccccc1)SC(=O)C)=O)=O