2-Butylbenzothiazole (CHEBI:179059)

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	2-Butylbenzothiazole

ChEBI ID	CHEBI:179059

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C11H13NS

Net Charge

Average Mass

191.290

Monoisotopic Mass

191.07687

InChI

InChI=1S/C11H13NS/c1-2-3-8-11-12-9-6-4-5-7-10(9)13-11/h4-7H,2-3,8H2,1H3

InChIKey

TUCSLJFYSQXGEV-UHFFFAOYSA-N

SMILES

S1C(=NC=2C1=CC=CC2)CCCC

ChEBI Ontology
Outgoing	2-Butylbenzothiazole (CHEBI:179059) is a benzothiazoles (CHEBI:37947)

IUPAC Name

2-butyl-1,3-benzothiazole