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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H17F3N4O
Molecular Weight 422.4025
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(2-AZANYLQUINAZOLIN-6-YL)-4-METHYL-N-(3-(TRIFLUOROMETHYL)PHENYL)BENZAMIDE

SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)C(F)(F)F)C3=CC4=C(C=C3)N=C(N)N=C4

InChI

InChIKey=YEIASMOUYNOXGA-UHFFFAOYSA-N
InChI=1S/C23H17F3N4O/c1-13-5-6-15(21(31)29-18-4-2-3-17(11-18)23(24,25)26)10-19(13)14-7-8-20-16(9-14)12-28-22(27)30-20/h2-12H,1H3,(H,29,31)(H2,27,28,30)

HIDE SMILES / InChI

Molecular Formula C23H17F3N4O
Molecular Weight 422.4025
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 Wed Apr 02 07:12:13 GMT 2025
Edited
by admin
on Wed Apr 02 07:12:13 GMT 2025
Record UNII
T52FE17W1Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(2-AZANYLQUINAZOLIN-6-YL)-4-METHYL-N-(3-(TRIFLUOROMETHYL)PHENYL)BENZAMIDE
Systematic Name English
BENZAMIDE, 3-(2-AMINO-6-QUINAZOLINYL)-4-METHYL-N-(3-(TRIFLUOROMETHYL)PHENYL)-
Preferred Name English
Code System Code Type Description
FDA UNII
T52FE17W1Y
Created by admin on Wed Apr 02 07:12:13 GMT 2025 , Edited by admin on Wed Apr 02 07:12:13 GMT 2025
PRIMARY
PUBCHEM
15991573
Created by admin on Wed Apr 02 07:12:13 GMT 2025 , Edited by admin on Wed Apr 02 07:12:13 GMT 2025
PRIMARY
CAS
882664-95-1
Created by admin on Wed Apr 02 07:12:13 GMT 2025 , Edited by admin on Wed Apr 02 07:12:13 GMT 2025
PRIMARY