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Details

Stereochemistry ACHIRAL
Molecular Formula C20H13ClF3N3O3S
Molecular Weight 467.849
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,4-Oxadiazol-5(2H)-one, 3-[2-chloro-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methoxy]phenyl]-

SMILES

CC1=C(COC2=CC=C(C3=NOC(=O)N3)C(Cl)=C2)SC(=N1)C4=CC=C(C=C4)C(F)(F)F

InChI

InChIKey=JTTLRZWXLHSLBV-UHFFFAOYSA-N
InChI=1S/C20H13ClF3N3O3S/c1-10-16(31-18(25-10)11-2-4-12(5-3-11)20(22,23)24)9-29-13-6-7-14(15(21)8-13)17-26-19(28)30-27-17/h2-8H,9H2,1H3,(H,26,27,28)

HIDE SMILES / InChI

Molecular Formula C20H13ClF3N3O3S
Molecular Weight 467.849
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 20:55:06 GMT 2025
Edited
by admin
on Wed Apr 02 20:55:06 GMT 2025
Record UNII
SP3EJW6EKH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-[2-Chloro-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methoxy]phenyl]-1,2,4-oxadiazol-5(2H)-one
Preferred Name English
1,2,4-Oxadiazol-5(2H)-one, 3-[2-chloro-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methoxy]phenyl]-
Systematic Name English
Code System Code Type Description
FDA UNII
SP3EJW6EKH
Created by admin on Wed Apr 02 20:55:06 GMT 2025 , Edited by admin on Wed Apr 02 20:55:06 GMT 2025
PRIMARY
CAS
866920-24-3
Created by admin on Wed Apr 02 20:55:06 GMT 2025 , Edited by admin on Wed Apr 02 20:55:06 GMT 2025
PRIMARY
PUBCHEM
135870773
Created by admin on Wed Apr 02 20:55:06 GMT 2025 , Edited by admin on Wed Apr 02 20:55:06 GMT 2025
PRIMARY
Related Record Type Details
TARGET -> AGONIST