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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H7F3N2O2S
Molecular Weight 240.203
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 2-AMINO-4-(TRIFLUOROMETHYL)-1,3-THIAZOLE-5-CARBOXYLATE

SMILES

CCOC(=O)C1=C(N=C(N)S1)C(F)(F)F

InChI

InChIKey=XJRPTMORGOIMMI-UHFFFAOYSA-N
InChI=1S/C7H7F3N2O2S/c1-2-14-5(13)3-4(7(8,9)10)12-6(11)15-3/h2H2,1H3,(H2,11,12)

HIDE SMILES / InChI

Molecular Formula C7H7F3N2O2S
Molecular Weight 240.203
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 Sat Dec 16 13:00:17 GMT 2023
Edited
by admin
on Sat Dec 16 13:00:17 GMT 2023
Record UNII
9WH6LMH3RA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 2-AMINO-4-(TRIFLUOROMETHYL)-1,3-THIAZOLE-5-CARBOXYLATE
Systematic Name English
NSC-4465
Code English
5-THIAZOLECARBOXYLIC ACID, 2-AMINO-4-(TRIFLUOROMETHYL)-, ETHYL ESTER
Systematic Name English
2-AMINO-4-(TRIFLUOROMETHYL)-5-THIAZOLECARBOXYLIC ACID ETHYL ESTER
Common Name English
Code System Code Type Description
NSC
4465
Created by admin on Sat Dec 16 13:00:18 GMT 2023 , Edited by admin on Sat Dec 16 13:00:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID0051491
Created by admin on Sat Dec 16 13:00:18 GMT 2023 , Edited by admin on Sat Dec 16 13:00:18 GMT 2023
PRIMARY
PUBCHEM
67656
Created by admin on Sat Dec 16 13:00:18 GMT 2023 , Edited by admin on Sat Dec 16 13:00:18 GMT 2023
PRIMARY
CAS
344-72-9
Created by admin on Sat Dec 16 13:00:17 GMT 2023 , Edited by admin on Sat Dec 16 13:00:17 GMT 2023
PRIMARY
CHEMBL
1890274
Created by admin on Sat Dec 16 13:00:18 GMT 2023 , Edited by admin on Sat Dec 16 13:00:18 GMT 2023
PRIMARY
FDA UNII
9WH6LMH3RA
Created by admin on Sat Dec 16 13:00:18 GMT 2023 , Edited by admin on Sat Dec 16 13:00:18 GMT 2023
PRIMARY