1,3-benzothiazole-2-thiol (CHEBI:34292)

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ChEBI Name	1,3-benzothiazole-2-thiol

ChEBI ID	CHEBI:34292

Definition	1,3-Benzothiazole substituted at the 2-position with a sulfanyl group.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:282886

Supplier Information

Download	Molfile XML SDF

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Formula

C7H5NS2

Net Charge

Average Mass

167.25100

Monoisotopic Mass

166.98634

InChI

InChI=1S/C7H5NS2/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)

InChIKey

YXIWHUQXZSMYRE-UHFFFAOYSA-N

SMILES

Sc1nc2ccccc2s1

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. carcinogenic agent A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.

ChEBI Ontology
Outgoing	1,3-benzothiazole-2-thiol (CHEBI:34292) has role carcinogenic agent (CHEBI:50903) 1,3-benzothiazole-2-thiol (CHEBI:34292) has role metabolite (CHEBI:25212) 1,3-benzothiazole-2-thiol (CHEBI:34292) is a aryl thiol (CHEBI:82711) 1,3-benzothiazole-2-thiol (CHEBI:34292) is a benzothiazoles (CHEBI:37947)

Incoming	dibenzothiazol-2-yl disulfide (CHEBI:53239) has functional parent 1,3-benzothiazole-2-thiol (CHEBI:34292) tyrphostin AG 825 (CHEBI:75405) has functional parent 1,3-benzothiazole-2-thiol (CHEBI:34292)

IUPAC Name

1,3-benzothiazole-2-thiol

Synonyms	Sources
1,3-Benzothiazol-2-yl hydrosulfide	NIST Chemistry WebBook
2-Benzothiazolethiol	ChemIDplus
2-MBT	ChemIDplus
2-Mercaptobenzothiazole	KEGG COMPOUND
2-sulfanyl-1,3-benzothiazole	ChEBI
Benzothiazole-2-thiol	ChEMBL
Benzothiazolethiol	UM-BBD
benzothiazolyl mercaptan	ChEBI
Captax	KEGG COMPOUND
MBT	UM-BBD
Mercaptobenzothiazole	ChemIDplus

Last Modified

25 February 2016