Methyl 2-[(2-methyl-4-quinolyl)thio]acetate (CHEBI:194948)

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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	Methyl 2-[(2-methyl-4-quinolyl)thio]acetate

ChEBI ID	CHEBI:194948

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H13NO2S

Net Charge

Average Mass

247.310

Monoisotopic Mass

247.06670

InChI

InChI=1S/C13H13NO2S/c1-9-7-12(17-8-13(15)16-2)10-5-3-4-6-11(10)14-9/h3-7H,8H2,1-2H3

InChIKey

QNJWFNICGDNCCT-UHFFFAOYSA-N

SMILES

S(C=1C=2C(N=C(C1)C)=CC=CC2)CC(OC)=O

ChEBI Ontology
Outgoing	Methyl 2-[(2-methyl-4-quinolyl)thio]acetate (CHEBI:194948) is a quinolines (CHEBI:26513)

IUPAC Name

methyl 2-(2-methylquinolin-4-yl)sulanylacetate