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Substance Name: 3Clpro-1
RN: 1065478-52-5
UNII: LVW7NK5EFO
InChIKey: HXAHMXYAYHWWRI-ZCTWNQIISA-N

Molecular Formula

  • C25-H25-Cl-F-N3-O4

Molecular Weight

  • 485.9351
 
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Names and Synonyms

Name of Substance

  • 3Clpro-1

Synonyms

  • 2-(2-((4-Chloro-2-fluoro)cinnamoyl)amino-1-oxo-3-phenyl)propyl amino-3-(2-oxo-3-pyrrolidyl)-propan-1-al
  • 3Clpro-1
  • Benzenepropanamide, alpha-(((2E)-3-(4-chloro-2-fluorophenyl)-1-oxo-2-propen-1-yl)amino)-N-((1S)-1-formyl-2-((3S)-2-oxo-3-pyrrolidinyl)ethyl)-, (alphaS)-
  • UNII-LVW7NK5EFO

Registry Numbers

CAS Registry Number

  • 1065478-52-5

FDA UNII

  • LVW7NK5EFO

System Generated Number

  • 1065478525

Structure Descriptors

InChI

1S/C25H25ClFN3O4/c26-19-8-6-17(21(27)14-19)7-9-23(32)30-22(12-16-4-2-1-3-5-16)25(34)29-20(15-31)13-18-10-11-28-24(18)33/h1-9,14-15,18,20,22H,10-13H2,(H,28,33)(H,29,34)(H,30,32)/b9-7+/t18-,20-,22-/m0/s1

InChIKey

HXAHMXYAYHWWRI-ZCTWNQIISA-N

Smiles

Fc1cc(Cl)ccc1\C=C\C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C[C@@H]3CCNC3=O)C=O