Vitas-M small molecule compound

ethyl 1-[(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)acetyl]piperidine-4-carboxylate

Catalog ID
STK862641
SMILES CCOC(=O)C1CCN(CC1)C(=O)CN1C(=O)c2c(S1(=O)=O)cccc2

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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 C17H20N2O6S MW 380.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O6S/c1-2-25-17(22)12-7-9-18(10-8-12)15(20)11-19-16(21)13-5-3-4-6-14(13)26(19,23)24/h3-6,12H,2,7-11H2,1H3
InChIKey
YMNLVERVXCHSCX-UHFFFAOYSA-N
Synonyms
380318-96-7
1(2(113TRIOXO13DIHYDRO1LAMBDA6BENZO(D)ISOTHIAZOL2YL)ACETYL)PIPERIDINE4CARBOXYLICACIDETHYLESTER
380318967
CCOC(=O)C1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O
ETHYL1((11DIOXIDO3OXO12BENZISOTHIAZOL2(3H)YL)ACETYL)4PIPERIDINECARBOXYLATE
ethyl1((11dioxido3oxo12benzothiazol2(3H)yl)acetyl)piperidine4carboxylate
ETHYL1(2(113TRIOXO12BENZOTHIAZOL2YL)ACETYL)PIPERIDINE4CARBOXYLATE
ETHYL1(2(113TRIOXO2HYDROBENZO(D)ISOTHIAZOL2YL)ACETYL)PIPERIDINE4CARBOXYLATE
ETHYL1(2(11DIOXIDO3OXOBENZO(D)ISOTHIAZOL2(3H)YL)ACETYL)PIPERIDINE4CARBOXYLATE
InChI=1SC17H20N2O6Sc122517(22)127918(10812)15(20)111916(21)13534614(13)26(1923)24h3612H2711H21H3
MFCD02724327
ZINC000000802962
ZINC00802962
ZINC802962

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Available files

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