Vitas-M small molecule compound

3-acetyl-2-(2-ethoxy-2-oxoethyl)-1,1-dioxido-2H-1,2-benzothiazin-4-yl propanoate

Catalog ID
STK605670
SMILES CCOC(=O)CN1C(=C(OC(=O)CC)c2c(S1(=O)=O)cccc2)C(=O)C

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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 C17H19NO7S MW 381.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO7S/c1-4-14(20)25-17-12-8-6-7-9-13(12)26(22,23)18(16(17)11(3)19)10-15(21)24-5-2/h6-9H,4-5,10H2,1-3H3
InChIKey
SIQYYVYZNZMVDO-UHFFFAOYSA-N
Synonyms
919720-12-0
(3acetyl2(2ethoxy2oxoethyl)11dioxo1$l^(6)2benzothiazin4yl)propanoate
3acetyl2(2ethoxy2oxoethyl)11dioxido2H12benzothiazin4ylpropanoate
3acetyl2(2ethoxy2oxoethyl)11dioxido2Hbenzo(e)(12)thiazin4ylpropionate
919720120
CCC(=O)OC1=C(N(S(=O)(=O)C2=CC=CC=C21)CC(=O)OCC)C(=O)C
InChI=1SC17H19NO7Sc1414(20)251712867913(12)26(2223)18(16(17)11(3)19)1015(21)2452h69H4510H213H3
MFCD08747971
ZINC000009306858
ZINC09306858
ZINC9306858

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Available files

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