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Details

Stereochemistry ACHIRAL
Molecular Formula C22H16N6O
Molecular Weight 380.402
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RDEA-427

SMILES

CC1=CC(=CC(C)=C1OC2=C3C=CNC3=NC(NC4=CC=C(C=C4)C#N)=N2)C#N

InChI

InChIKey=PFGKQRWHIVJCSQ-UHFFFAOYSA-N
InChI=1S/C22H16N6O/c1-13-9-16(12-24)10-14(2)19(13)29-21-18-7-8-25-20(18)27-22(28-21)26-17-5-3-15(11-23)4-6-17/h3-10H,1-2H3,(H2,25,26,27,28)

HIDE SMILES / InChI

Molecular Formula C22H16N6O
Molecular Weight 380.402
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:16:34 GMT 2025
Edited
by admin
on Wed Apr 02 19:16:34 GMT 2025
Record UNII
TN5U9ATH6E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RDEA-427
Code English
4-[[2-[(4-Cyanophenyl)amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]oxy]-3,5-dimethylbenzonitrile
Preferred Name English
Benzonitrile, 4-[[2-[(4-cyanophenyl)amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]oxy]-3,5-dimethyl-
Systematic Name English
Code System Code Type Description
FDA UNII
TN5U9ATH6E
Created by admin on Wed Apr 02 19:16:34 GMT 2025 , Edited by admin on Wed Apr 02 19:16:34 GMT 2025
PRIMARY
PUBCHEM
57693582
Created by admin on Wed Apr 02 19:16:34 GMT 2025 , Edited by admin on Wed Apr 02 19:16:34 GMT 2025
PRIMARY
CAS
914496-19-8
Created by admin on Wed Apr 02 19:16:34 GMT 2025 , Edited by admin on Wed Apr 02 19:16:34 GMT 2025
PRIMARY
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