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Details

Stereochemistry ACHIRAL
Molecular Formula C21H19N5O2
Molecular Weight 373.4079
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(4-((2-(4-CYANOANILINO)PYRIMIDIN-4-YL)AMINO)-3,5-DIMETHYL-PHENYL)ACETIC ACID

SMILES

CC1=CC(CC(O)=O)=CC(C)=C1NC2=NC(NC3=CC=C(C=C3)C#N)=NC=C2

InChI

InChIKey=ZUQUHUMJWZJBFL-UHFFFAOYSA-N
InChI=1S/C21H19N5O2/c1-13-9-16(11-19(27)28)10-14(2)20(13)25-18-7-8-23-21(26-18)24-17-5-3-15(12-22)4-6-17/h3-10H,11H2,1-2H3,(H,27,28)(H2,23,24,25,26)

HIDE SMILES / InChI

Molecular Formula C21H19N5O2
Molecular Weight 373.4079
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 Thu Jul 06 20:45:34 UTC 2023
Edited
by admin
on Thu Jul 06 20:45:34 UTC 2023
Record UNII
2JV732ZJ2C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(4-((2-(4-CYANOANILINO)PYRIMIDIN-4-YL)AMINO)-3,5-DIMETHYL-PHENYL)ACETIC ACID
Systematic Name English
RILPIVIRINE METABOLITE 30
Common Name English
Code System Code Type Description
PUBCHEM
155929037
Created by admin on Thu Jul 06 20:45:34 UTC 2023 , Edited by admin on Thu Jul 06 20:45:34 UTC 2023
PRIMARY
FDA UNII
2JV732ZJ2C
Created by admin on Thu Jul 06 20:45:34 UTC 2023 , Edited by admin on Thu Jul 06 20:45:34 UTC 2023
PRIMARY
Related Record Type Details
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