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Substance Name: Pentanamide, N-(2-chloro-5-((hexadecylsulfonyl)amino)phenyl)-4,4-dimethyl-3-oxo-2-(4-((4-(phenylmethoxy)phenyl)sulfonyl)phenoxy)-
RN: 56912-29-9
InChIKey: WUJTWJZEQRSSPU-UHFFFAOYSA-N

Molecular Formula

  • C48-H63-Cl-N2-O8-S2

Molecular Weight

  • 895.617
 
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Names and Synonyms

Synonym

  • EINECS 260-427-5

Systematic Names

  • N-(2-Chloro-5-((hexadecylsulphonyl)amino)phenyl)-4,4-dimethyl-3-oxo-2-(4-((4-(phenylmethoxy)phenyl)sulphonyl)phenoxy)valeramide
  • Pentanamide, N-(2-chloro-5-((hexadecylsulfonyl)amino)phenyl)-4,4-dimethyl-3-oxo-2-(4-((4-(phenylmethoxy)phenyl)sulfonyl)phenoxy)-

Registry Numbers

CAS Registry Number

  • 56912-29-9

System Generated Number

  • 0056912299

Structure Descriptors

InChI

1S/C48H63ClN2O8S2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-34-60(54,55)51-38-24-33-43(49)44(35-38)50-47(53)45(46(52)48(2,3)4)59-40-27-31-42(32-28-40)61(56,57)41-29-25-39(26-30-41)58-36-37-22-19-18-20-23-37/h18-20,22-33,35,45,51H,5-17,21,34,36H2,1-4H3,(H,50,53)

InChIKey

WUJTWJZEQRSSPU-UHFFFAOYSA-N

Smiles

C(CS(=O)(=O)Nc1cc(c(cc1)Cl)NC([C@@H](C(C(C)(C)C)=O)Oc1ccc(cc1)S(=O)(=O)c1ccc(cc1)OCc1ccccc1)=O)CCCCCCCCCCCCCC