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acibenzolar-S-methyl

Properties

Image

Occurences in reactions

MNX_ID

MNXM151776

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₈H₆N₂OS₂

charge

mass

209.99215

reference

InChIKey

UELITFHSCLAHKR-UHFFFAOYSA-N

InChI

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

SMILES

CSC(=O)c1cccc2nnsc12

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:73178 chebi:73178	acibenzolar-S-methyl 1,2,3-benzothiadiazole-7-carboxlic acid thiomethyl ester 7-(methylthiocarbonyl)-benzo-1,2,3-thiadiazole Actigard BTH S-methyl 1,2,3-benzothiadiazole-7-carbothioate S-methyl benzo[1,2,3]thiadiazole-7-carbothioate benzo-(1,2,3)-thiadiazole-7-carbothioic acid S-methyl ester
seed.compound:cpd32382 seedM:cpd32382	ASM BTH derivative acibenzolar-S-methyl benzo(1,2,3)-thiadiazole-7-carbothioic acid S-methyl ester benzothiadiazole derivative
envipath:...a104b2f1acb0 envipathM:...a104b2f1acb0 envipath:...47554f9dd7aa envipathM:...47554f9dd7aa	Acibenzolar-S-Methyl
metacyc.compound:CPD-19219 metacycM:CPD-19219	acibenzolar-S-methyl ASM BTH derivative benzo(1,2,3)-thiadiazole-7-carbothioic acid S-methyl ester benzothiadiazole derivative
envipath:...82ab462f56ee envipathM:...82ab462f56ee	compound 0044621
seedM:M_cpd32382	secondary/obsolete/fantasy identifier