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Substance Name: AG 1254
RN: 163633-45-2
InChIKey: XKLHCHNIJIXLKU-MFMCTBQISA-N

Molecular Formula

  • C33-H36-N2-O4-S

Molecular Weight

  • 556.7234
 
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Names and Synonyms

Results Name

  • AG 1254

Synonyms

  • AG 1254
  • AG1254

Systematic Name

  • Benzamide, N-(3-(2-(((1,1-dimethylethyl)amino)carbonyl)phenyl)-2-hydroxy-1-((2-naphthalenylthio)methyl)propyl)-3-hydroxy-2-methyl-, (R-(R*,R*))-

Registry Numbers

CAS Registry Number

  • 163633-45-2

System Generated Number

  • 0163633452

Structure Descriptors

InChI

1S/C33H36N2O4S/c1-21-26(14-9-15-29(21)36)31(38)34-28(20-40-25-17-16-22-10-5-6-11-23(22)18-25)30(37)19-24-12-7-8-13-27(24)32(39)35-33(2,3)4/h5-18,28,30,36-37H,19-20H2,1-4H3,(H,34,38)(H,35,39)/t28-,30+/m0/s1

InChIKey

XKLHCHNIJIXLKU-MFMCTBQISA-N

Smiles

Cc1c(cccc1O)C(=O)N[C@@H](CSc2ccc3ccccc3c2)[C@@H](Cc4ccccc4C(=O)NC(C)(C)C)O