Vitas-M small molecule compound

methyl 1,2,3-benzothiadiazole-6-carboxylate

Catalog ID
STK009865
SMILES COC(=O)c1ccc2c(c1)snn2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C8H6N2O2S MW 194.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H6N2O2S/c1-12-8(11)5-2-3-6-7(4-5)13-10-9-6/h2-4H,1H3
InChIKey
RLPJBFFHKGWDAY-UHFFFAOYSA-N
Synonyms
39588-43-7
123BENZOTHIADIAZOLE6CARBOXYLICACIDMETHYLESTER
39588437
BENZO(123)THIADIAZOLE6CARBOXYLICACIDMETHYLESTER
COC(=O)C1=CC2=C(C=C1)N=NS2
COC(=O)c1ccc2c(c1)snn2
InChI=1SC8H6N2O2Sc1128(11)52367(45)131096h24H1H3
METHYL123BENZOTHIADIAZOLE6CARBOXYLATE
methylbenzo(d)(123)thiadiazole6carboxylate
MFCD00749302
STK009865
ZINC000000227771
ZINC00227771
ZINC227771

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.