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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H18N6O
Molecular Weight 382.4179
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 5-HYDROXY-RILPIVIRINE

SMILES

CC1=CC(\C=C\C#N)=CC(C)=C1NC2=NC(NC3=CC=C(C=C3)C#N)=NC=C2O

InChI

InChIKey=VTMGKGPTCMSHPX-ONEGZZNKSA-N
InChI=1S/C22H18N6O/c1-14-10-17(4-3-9-23)11-15(2)20(14)27-21-19(29)13-25-22(28-21)26-18-7-5-16(12-24)6-8-18/h3-8,10-11,13,29H,1-2H3,(H2,25,26,27,28)/b4-3+

HIDE SMILES / InChI

Molecular Formula C22H18N6O
Molecular Weight 382.4179
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:49:46 UTC 2023
Edited
by admin
on Sat Dec 16 11:49:46 UTC 2023
Record UNII
ZUD5IN2ZQ7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-HYDROXY-RILPIVIRINE
Common Name English
4-((4-(4-((E)-2-CYANOVINYL)-2,6-DIMETHYL-ANILINO)-5-HYDROXY-PYRIMIDIN-2-YL)AMINO)BENZONITRILE
Systematic Name English
RILPIVIRINE METABOLITE 42
Common Name English
Code System Code Type Description
FDA UNII
ZUD5IN2ZQ7
Created by admin on Sat Dec 16 11:49:46 UTC 2023 , Edited by admin on Sat Dec 16 11:49:46 UTC 2023
PRIMARY
PUBCHEM
138393907
Created by admin on Sat Dec 16 11:49:46 UTC 2023 , Edited by admin on Sat Dec 16 11:49:46 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE