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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H12Cl2FN3O
Molecular Weight 316.158
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Chloro-2-[(2-chloro-4-pyrimidinyl)amino]-5-fluoro-?,?-dimethylbenzenemethanol

SMILES

CC(C)(O)C1=C(NC2=NC(Cl)=NC=C2)C=C(Cl)C(F)=C1

InChI

InChIKey=DOPRFCZCYMJWJV-UHFFFAOYSA-N
InChI=1S/C13H12Cl2FN3O/c1-13(2,20)7-5-9(16)8(14)6-10(7)18-11-3-4-17-12(15)19-11/h3-6,20H,1-2H3,(H,17,18,19)

HIDE SMILES / InChI

Approval Year

Name Type Language
Benzenemethanol, 4-chloro-2-[(2-chloro-4-pyrimidinyl)amino]-5-fluoro-?,?-dimethyl-
Preferred Name English
4-Chloro-2-[(2-chloro-4-pyrimidinyl)amino]-5-fluoro-?,?-dimethylbenzenemethanol
Systematic Name English
Code System Code Type Description
FDA UNII
PC4FD5MQV9
Created by admin on Wed Apr 02 19:11:24 GMT 2025 , Edited by admin on Wed Apr 02 19:11:24 GMT 2025
PRIMARY
PUBCHEM
155174478
Created by admin on Wed Apr 02 19:11:24 GMT 2025 , Edited by admin on Wed Apr 02 19:11:24 GMT 2025
PRIMARY
CAS
2370037-75-3
Created by admin on Wed Apr 02 19:11:24 GMT 2025 , Edited by admin on Wed Apr 02 19:11:24 GMT 2025
PRIMARY