VU-0409106

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H11FN4O2S
Molecular Weight	330.337
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CSC(NC(=O)C2=CC(OC3=CN=CN=C3)=CC(F)=C2)=N1

InChI

InChIKey=AXVLPJHYYFHCHK-UHFFFAOYSA-N

InChI=1S/C15H11FN4O2S/c1-9-7-23-15(19-9)20-14(21)10-2-11(16)4-12(3-10)22-13-5-17-8-18-6-13/h2-8H,1H3,(H,19,20,21)

HIDE SMILES / InChI

Molecular Formula	C15H11FN4O2S
Molecular Weight	330.337
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Metabotropic glutamate receptor 5 40 Target ID: CHEMBL3227 Sources: https://www.ncbi.nlm.nih.gov/pubmed/24074843	Negative Allosteric Modulator 43		6.8 nM [Ki]

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:21:37 GMT 2025` Edited by `admin` on `Wed Apr 02 12:21:37 GMT 2025`
Record UNII	J65UDU5WEA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VU-0409106

Code

English

VU0409106

Preferred Name

English

3-FLUORO-N-(4-METHYL-2-THIAZOLYL)-5-(5-PYRIMIDINYLOXY)BENZAMIDE

Systematic Name

English

BENZAMIDE, 3-FLUORO-N-(4-METHYL-2-THIAZOLYL)-5-(5-PYRIMIDINYLOXY)-

Systematic Name

English

Code System Code Type Description

FDA UNII

J65UDU5WEA

Created by admin on Wed Apr 02 12:21:37 GMT 2025 , Edited by admin on Wed Apr 02 12:21:37 GMT 2025

PRIMARY

PUBCHEM

50990953

Created by admin on Wed Apr 02 12:21:37 GMT 2025 , Edited by admin on Wed Apr 02 12:21:37 GMT 2025

PRIMARY

CAS

1276617-62-9

Created by admin on Wed Apr 02 12:21:37 GMT 2025 , Edited by admin on Wed Apr 02 12:21:37 GMT 2025

PRIMARY

SCIFINDER

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3-FLUORO-N-(4-METHYLTHIAZOL-2-YL)-5-((6-OXO-1H-PYRIMIDIN-5-YL)OXY)BENZAMIDE

METABOLITE -> PARENT