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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H13ClFN3O3
Molecular Weight 361.755
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(3-Chloro-4-fluorophenylamino)-7-methoxyquinazolin-6-yl acetate

SMILES

COC1=CC2=C(C=C1OC(C)=O)C(NC3=CC(Cl)=C(F)C=C3)=NC=N2

InChI

InChIKey=ANGPUOTYQQFHKN-UHFFFAOYSA-N
InChI=1S/C17H13ClFN3O3/c1-9(23)25-16-6-11-14(7-15(16)24-2)20-8-21-17(11)22-10-3-4-13(19)12(18)5-10/h3-8H,1-2H3,(H,20,21,22)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
4-(3-Chloro-4-fluorophenylamino)-7-methoxyquinazolin-6-yl acetate
Systematic Name English
6-Acetoxy-4-(3-chloro-4-fluorophenylamino)-7-methoxyquinazoline
Systematic Name English
6-Quinazolinol, 4-[(3-chloro-4-fluorophenyl)amino]-7-methoxy-, acetate (ester)
Systematic Name English
6-Quinazolinol, 4-[(3-chloro-4-fluorophenyl)amino]-7-methoxy-, 6-acetate
Systematic Name English
Code System Code Type Description
PUBCHEM
21098396
Created by admin on Sat Dec 16 19:49:37 GMT 2023 , Edited by admin on Sat Dec 16 19:49:37 GMT 2023
PRIMARY
CAS
788136-89-0
Created by admin on Sat Dec 16 19:49:37 GMT 2023 , Edited by admin on Sat Dec 16 19:49:37 GMT 2023
PRIMARY
FDA UNII
R3EQ3HZ35P
Created by admin on Sat Dec 16 19:49:37 GMT 2023 , Edited by admin on Sat Dec 16 19:49:37 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966