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Substance Name: Rupintrivir [USAN:INN]
RN: 223537-30-2
UNII: RGE5K1Q5QW
InChIKey: CAYJBRBGZBCZKO-BHGBQCOSSA-N

Note

  • A rhinovirus 3C protease inhibitor.

Classification Code

  • Antiviral Intended for use in the Treatment of the Common Cold (Human Rhinovirus 3C Protease Inhibitor)

Molecular Formula

  • C31-H39-F-N4-O7

Molecular Weight

  • 598.668
 
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Names and Synonyms

Name of Substance

  • Rupintrivir [USAN:INN]

Synonyms

  • 2-Pentenoic acid, 4-(((2R,5S)-2-((4-fluorophenyl)methyl)-6-methyl-5-(((5-methyl-3-isoxazolyl)carbonyl)amino)-1,4-dioxoheptyl)amino)-5-((3S)-2-oxo-3-pyrrolidinyl)-, ethylester, (2E,4S)-
  • AG7088
  • Ethyl (2E,4S)-4-(((2R,5S)-2-(4-fluorobenzyl)-6-methyl-5-(((5-methylisoxazol-3-yl)carbonyl)amino)-4-oxoheptanoyl)amino)-5-((3S)-2-oxopyrrolidin-3-yl)pent-2-enoate
  • Rupintrivir
  • UNII-RGE5K1Q5QW

Systematic Names

  • 2-Pentenoic acid, 4-(((2R,5S)-2-((4-fluorophenyl)methyl)-6-methyl-5-(((5-methyl-3-isoxazolyl)carbonyl)amino)-1,4-dioxoheptyl)amino)-5-((3S)-2-oxo-3-pyrrolidinyl)-, ethyl ester, (2E,4S)-
  • Ethyl (2E,4S)-4-(((2R,5S)-2-(4-fluorobenzyl)-6-methyl-5-(((5-methylisoxazol-3-yl)carbonyl)amino)-4-oxoheptanoyl)amino)-5-((3S)-2-oxopyrrolidin-3-yl)pent-2-enoate

Registry Numbers

CAS Registry Number

  • 223537-30-2

FDA UNII

  • RGE5K1Q5QW

System Generated Number

  • 0223537302

Structure Descriptors

InChI

1S/C31H39FN4O7/c1-5-42-27(38)11-10-24(16-21-12-13-33-29(21)39)34-30(40)22(15-20-6-8-23(32)9-7-20)17-26(37)28(18(2)3)35-31(41)25-14-19(4)43-36-25/h6-11,14,18,21-22,24,28H,5,12-13,15-17H2,1-4H3,(H,33,39)(H,34,40)(H,35,41)/b11-10+/t21-,22+,24+,28-/m0/s1

InChIKey

CAYJBRBGZBCZKO-BHGBQCOSSA-N

Smiles

C(\C=C\[C@H](C[C@H]1C(NCC1)=O)NC([C@@H](CC([C@H](C(C)C)NC(=O)c1noc(c1)C)=O)Cc1ccc(cc1)F)=O)(=O)OCC