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Details

Stereochemistry ACHIRAL
Molecular Formula C12H9F3N2O2
Molecular Weight 270.2073
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-METHYL-N-(3-(TRIFLUOROMETHYL)PHENYL)ISOXAZOLE-4-CARBOXAMIDE

SMILES

CC1=C(C=NO1)C(=O)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChIKey=KBFQQKBZIFSAMY-UHFFFAOYSA-N
InChI=1S/C12H9F3N2O2/c1-7-10(6-16-19-7)11(18)17-9-4-2-3-8(5-9)12(13,14)15/h2-6H,1H3,(H,17,18)

HIDE SMILES / InChI

Molecular Formula C12H9F3N2O2
Molecular Weight 270.2073
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 00:43:16 GMT 2023
Edited
by admin
on Sat Dec 16 00:43:16 GMT 2023
Record UNII
G7D26R0ANW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-METHYL-N-(3-(TRIFLUOROMETHYL)PHENYL)ISOXAZOLE-4-CARBOXAMIDE
Systematic Name English
4-ISOXAZOLECARBOXAMIDE, 5-METHYL-N-(3-(TRIFLUOROMETHYL)PHENYL)-
Systematic Name English
LEFLUNOMIDE RELATED COMPOUND C [USP-RS]
Common Name English
LEFLUNOMIDE RELATED COMPOUND C [USP IMPURITY]
Common Name English
LEFLUNOMIDE IMPURITY C [EP IMPURITY]
Common Name English
LEFLUNOMIDE RELATED COMPOUND C
USP   USP-RS  
Common Name English
Code System Code Type Description
FDA UNII
G7D26R0ANW
Created by admin on Sat Dec 16 00:43:16 GMT 2023 , Edited by admin on Sat Dec 16 00:43:16 GMT 2023
PRIMARY
RS_ITEM_NUM
1357067
Created by admin on Sat Dec 16 00:43:16 GMT 2023 , Edited by admin on Sat Dec 16 00:43:16 GMT 2023
PRIMARY
PUBCHEM
7314718
Created by admin on Sat Dec 16 00:43:16 GMT 2023 , Edited by admin on Sat Dec 16 00:43:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID40210661
Created by admin on Sat Dec 16 00:43:16 GMT 2023 , Edited by admin on Sat Dec 16 00:43:16 GMT 2023
PRIMARY
CAS
61643-23-0
Created by admin on Sat Dec 16 00:43:16 GMT 2023 , Edited by admin on Sat Dec 16 00:43:16 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
UNSPECIFIED
EP