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Details

Stereochemistry EPIMERIC
Molecular Formula C27H32F3N5O4
Molecular Weight 547.5693
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ratutrelvir

SMILES

CC(C)(C)[C@H](NC(=O)C(F)(F)F)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@@H](CC3C(=O)NC4=CC=CC=C34)C#N)C2(C)C

InChI

InChIKey=VVIHXCHAXVESGZ-MXEWLHNESA-N
InChI=1S/C27H32F3N5O4/c1-25(2,3)20(34-24(39)27(28,29)30)23(38)35-12-16-18(26(16,4)5)19(35)22(37)32-13(11-31)10-15-14-8-6-7-9-17(14)33-21(15)36/h6-9,13,15-16,18-20H,10,12H2,1-5H3,(H,32,37)(H,33,36)(H,34,39)/t13-,15?,16-,18-,19-,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H32F3N5O4
Molecular Weight 547.5693
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 5 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 21:23:34 GMT 2025
Edited
by admin
on Wed Apr 02 21:23:34 GMT 2025
Record UNII
VR2S5588W2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ratutrelvir
Common Name English
(1R,2S,5S)-N-{(1S)-1-cyano-2-[(3RS)-2-oxo-2,3-dihydro-1H-indol-3-yl]ethyl}-3-[(2S)-3,3-dimethyl-2-(2,2,2-trifluoroacetamido)butanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
Preferred Name English
ratutrelvir [INN]
Common Name English
3-Azabicyclo[3.1.0]hexane-2-carboxamide, N-[(1S)-1-cyano-2-(2,3-dihydro-2-oxo-1H-indol-3-yl)ethyl]-3-[(2S)-3,3-dimethyl-1-oxo-2-[(2,2,2-trifluoroacetyl)amino]butyl]-6,6-dimethyl-, (1R,2S,5S)-
Common Name English
Code System Code Type Description
INN
13531
Created by admin on Wed Apr 02 21:23:34 GMT 2025 , Edited by admin on Wed Apr 02 21:23:34 GMT 2025
PRIMARY
FDA UNII
VR2S5588W2
Created by admin on Wed Apr 02 21:23:34 GMT 2025 , Edited by admin on Wed Apr 02 21:23:34 GMT 2025
PRIMARY
PUBCHEM
169861725
Created by admin on Wed Apr 02 21:23:34 GMT 2025 , Edited by admin on Wed Apr 02 21:23:34 GMT 2025
PRIMARY
CAS
2929236-94-0
Created by admin on Wed Apr 02 21:23:34 GMT 2025 , Edited by admin on Wed Apr 02 21:23:34 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY
protease inhibitor, antiviral