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Substance Name: L 754394
RN: 160729-91-9
InChIKey: UBUFVRJUGFJQSI-PPJSLLJVSA-N

Note

  • A potent and specific inhibitor of the HIV-1 protease.

Molecular Formula

  • C38-H47-N5-O5

Molecular Weight

  • 653.819
 
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Names and Synonyms

Results Name

  • L 754394

Synonyms

  • L-754,394
  • L-754394

Systematic Name

  • 1-Piperazinepentanamide, N-((1S,2R)-2,3-dihydro-2-hydroxy-1H-inden-1-yl)-2-(((1,1-dimethylethyl)amino)carbonyl)-4-(furo(2,3-b)pyridin-5-ylmethyl)-gamma-hydroxy-alpha-(phenylmethyl)-, (alphaR,gammaS,2S)-

Registry Numbers

CAS Registry Number

  • 160729-91-9

System Generated Number

  • 0160729919

Structure Descriptors

InChI

1S/C38H47N5O5/c1-38(2,3)41-36(47)32-24-42(22-26-18-28-13-16-48-37(28)39-21-26)14-15-43(32)23-30(44)19-29(17-25-9-5-4-6-10-25)35(46)40-34-31-12-8-7-11-27(31)20-33(34)45/h4-13,16,18,21,29-30,32-34,44-45H,14-15,17,19-20,22-24H2,1-3H3,(H,40,46)(H,41,47)/t29-,30+,32+,33-,34+/m1/s1

InChIKey

UBUFVRJUGFJQSI-PPJSLLJVSA-N

Smiles

C1c2c([C@@H](NC([C@@H](C[C@@H](C[N@@]3[C@@H](C[N@@](Cc4cc5ccoc5nc4)CC3)C(=O)NC(C)(C)C)O)Cc3ccccc3)=O)[C@@H]1O)cccc2