4-(4-methoxyphenyl)-2-(methylthio)pyrimidine (CHEBI:183355)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	4-(4-methoxyphenyl)-2-(methylthio)pyrimidine

ChEBI ID	CHEBI:183355

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H12N2OS

Net Charge

Average Mass

232.300

Monoisotopic Mass

232.06703

InChI

InChI=1S/C12H12N2OS/c1-15-10-5-3-9(4-6-10)11-7-8-13-12(14-11)16-2/h3-8H,1-2H3

InChIKey

BEEYAIQJLUJSMQ-UHFFFAOYSA-N

SMILES

S(C=1N=C(C2=CC=C(OC)C=C2)C=CN1)C

Metabolite of Species	Details
Bombus terrestris (NCBI:txid30195)	Found in brain (BTO:0000142). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195)	Found in hemolymph (BTO:0000572). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195)	Found in hindgut (BTO:0000510). See: MetaboLights Study

ChEBI Ontology
Outgoing	4-(4-methoxyphenyl)-2-(methylthio)pyrimidine (CHEBI:183355) is a pyrimidines (CHEBI:39447)

IUPAC Name

4-(4-methoxyphenyl)-2-methylsulanylpyrimidine