Vitas-M small molecule compound

2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]ethyl 2-methoxybenzoate

Catalog ID
STK135038
SMILES COc1ccccc1C(=O)OCCNC1=NS(=O)(=O)c2c1cccc2

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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 C17H16N2O5S MW 360.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O5S/c1-23-14-8-4-2-6-12(14)17(20)24-11-10-18-16-13-7-3-5-9-15(13)25(21,22)19-16/h2-9H,10-11H2,1H3,(H,18,19)
InChIKey
BYEWNDHQQPYUCA-UHFFFAOYSA-N
Synonyms

2((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)ETHYL2METHOXYBENZOATE
2((11DIOXO12BENZOTHIAZOL3YL)AMINO)ETHYL2METHOXYBENZOATE
2METHOXYBENZOICACID2(11DIOXO1H1LAMBDA6BENZO(D)ISOTHIAZOL3YLAMINO)ETHYLESTER
COC1=CC=CC=C1C(=O)OCCNC2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC17H16N2O5Sc12314842612(14)17(20)241110181613735915(13)25(2122)1916h29H1011H21H3(H1819)
MFCD01207111
ZINC000004181209
ZINC04181209
ZINC4181209

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Available files

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