U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H17FN8O2
Molecular Weight 408.3891
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Rogocekib

SMILES

COC1=NC=NN2C=CC(=C12)C3=CC4=C(N=C(C)N4CC5=NN=C(O5)[C@@H](C)F)N=C3

InChI

InChIKey=OENNTZBJPRRGFL-SNVBAGLBSA-N
InChI=1S/C19H17FN8O2/c1-10(20)18-26-25-15(30-18)8-27-11(2)24-17-14(27)6-12(7-21-17)13-4-5-28-16(13)19(29-3)22-9-23-28/h4-7,9-10H,8H2,1-3H3/t10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H17FN8O2
Molecular Weight 408.3891
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 15:28:54 GMT 2025
Edited
by admin
on Wed Apr 02 15:28:54 GMT 2025
Record UNII
XE88VQP94E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
rogocekib [INN]
Preferred Name English
Rogocekib
INN  
Official Name English
1H-Imidazo[4,5-b]pyridine, 1-[[5-[(1R)-1-fluoroethyl]-1,3,4-oxadiazol-2-yl]methyl]-6-(4-methoxypyrrolo[2,1-f][1,2,4]triazin-5-yl)-2-methyl-
Systematic Name English
1-({5-[(1R)-1-Fluoroethyl]-1,3,4-oxadiazol-2-yl}methyl)-6-(4-methoxypyrrolo [2,1-f][1,2,4]triazin-5-yl)-2-methyl-1H-imidazo[4,5-b]pyridine
Systematic Name English
1-[[5-[(1R)-1-Fluoroethyl]-1,3,4-oxadiazol-2-yl]methyl]-6-(4-methoxypyrrolo[2,1-f][1,2,4]triazin-5-yl)-2-methyl-1H-imidazo[4,5-b]pyridine
Systematic Name English
Code System Code Type Description
PUBCHEM
138522180
Created by admin on Wed Apr 02 15:28:54 GMT 2025 , Edited by admin on Wed Apr 02 15:28:54 GMT 2025
PRIMARY
CAS
2144751-78-8
Created by admin on Wed Apr 02 15:28:54 GMT 2025 , Edited by admin on Wed Apr 02 15:28:54 GMT 2025
PRIMARY
FDA UNII
XE88VQP94E
Created by admin on Wed Apr 02 15:28:54 GMT 2025 , Edited by admin on Wed Apr 02 15:28:54 GMT 2025
PRIMARY
NCI_THESAURUS
C206982
Created by admin on Wed Apr 02 15:28:54 GMT 2025 , Edited by admin on Wed Apr 02 15:28:54 GMT 2025
PRIMARY
SMS_ID
300000054568
Created by admin on Wed Apr 02 15:28:54 GMT 2025 , Edited by admin on Wed Apr 02 15:28:54 GMT 2025
PRIMARY
INN
12894
Created by admin on Wed Apr 02 15:28:54 GMT 2025 , Edited by admin on Wed Apr 02 15:28:54 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY