acibenzolar-S-methyl (CHEBI:73178)

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ChEBI Name	acibenzolar-S-methyl

ChEBI ID	CHEBI:73178

ChEBI ASCII Name	acibenzolar-S-methyl

Definition	A benzothiadiazole that is the S-methyl thioester derivative of acibenzolar. A profungicide (by hydrolysis of the thioester group to give the corresponding carboxylic acid), it is used as a fungicide and plant activator on a variety of crops, including cotton, chili peppers, lettuce, onions, spinach, tobacco, and tomatoes.

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

Submitter	Johnny Lloyd

Supplier Information	eMolecules:10440773, ZINC000005734520

Download	Molfile XML SDF

Wikipedia	License
Acibenzolar-S-methyl is the ISO common name for an organic compound that is used as a fungicide. Unusually, it is not directly toxic to fungi but works by inducing systemic acquired resistance, the natural defence system of plants.
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Formula

C8H6N2OS2

Net Charge

Average Mass

210.27600

Monoisotopic Mass

209.99216

InChI

InChI=1S/C8H6N2OS2/c1-12-8(11)5-3-2-4-6-7(5)13-10-9-6/h2-4H,1H3

InChIKey

UELITFHSCLAHKR-UHFFFAOYSA-N

SMILES

CSC(=O)c1cccc2nnsc12

Roles Classification
Biological Role(s):	antifungal agrochemical Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties. profungicide A compound that, on administration, must undergo chemical conversion by metabolic processes before becoming the pharmacologically active fungicide for which it is a profungicide.

Application(s):	antifungal agrochemical Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties. plant activator Any compound that protects plants by activating their defence mechanisms. profungicide A compound that, on administration, must undergo chemical conversion by metabolic processes before becoming the pharmacologically active fungicide for which it is a profungicide.

ChEBI Ontology
Outgoing	acibenzolar-S-methyl (CHEBI:73178) has functional parent acibenzolar (CHEBI:73185) acibenzolar-S-methyl (CHEBI:73178) has role antifungal agrochemical (CHEBI:86328) acibenzolar-S-methyl (CHEBI:73178) has role plant activator (CHEBI:73182) acibenzolar-S-methyl (CHEBI:73178) has role profungicide (CHEBI:136645) acibenzolar-S-methyl (CHEBI:73178) is a benzothiadiazole (CHEBI:48864) acibenzolar-S-methyl (CHEBI:73178) is a thioester (CHEBI:51277)

IUPAC Name

S-methyl 1,2,3-benzothiadiazole-7-carbothioate

Synonyms	Sources
1,2,3-benzothiadiazole-7-carboxlic acid thiomethyl ester	ChEBI
7-(methylthiocarbonyl)-benzo-1,2,3-thiadiazole	ChEBI
benzo-(1,2,3)-thiadiazole-7-carbothioic acid S-methyl ester	ChEBI
BTH	ChEBI
S-methyl benzo[1,2,3]thiadiazole-7-carbothioate	ChEBI

Brand Name	Source
Actigard	ChemIDplus

Citations

Last Modified

31 March 2017