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Details

Stereochemistry ACHIRAL
Molecular Formula C11H6ClN3
Molecular Weight 215.638
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(2-Chloro-4-pyrimidinyl)benzonitrile

SMILES

ClC1=NC(=CC=N1)C2=CC=C(C=C2)C#N

InChI

InChIKey=QYZLKWFYMQFHCV-UHFFFAOYSA-N
InChI=1S/C11H6ClN3/c12-11-14-6-5-10(15-11)9-3-1-8(7-13)2-4-9/h1-6H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
4-(2-Chloro-4-pyrimidinyl)benzonitrile
Systematic Name English
4-(2-Chloropyrimidin-4-yl)benzonitrile
Preferred Name English
Benzonitrile, 4-(2-chloro-4-pyrimidinyl)-
Systematic Name English
Code System Code Type Description
FDA UNII
2M4CE3U5VF
Created by admin on Wed Apr 02 15:20:36 GMT 2025 , Edited by admin on Wed Apr 02 15:20:36 GMT 2025
PRIMARY
CAS
945756-16-1
Created by admin on Wed Apr 02 15:20:36 GMT 2025 , Edited by admin on Wed Apr 02 15:20:36 GMT 2025
PRIMARY
PUBCHEM
24901863
Created by admin on Wed Apr 02 15:20:36 GMT 2025 , Edited by admin on Wed Apr 02 15:20:36 GMT 2025
PRIMARY
NIH
NCATS
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