Vitas-M small molecule compound

4-{(E)-2-cyano-2-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]ethenyl}-2,6-dimethoxyphenyl acetate

Catalog ID
STK843991
SMILES N#C/C(=C\c1cc(OC)c(c(c1)OC)OC(=O)C)/c1scc(n1)c1cccc2c1cccc2

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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 C26H20N2O4S MW 456.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O4S/c1-16(29)32-25-23(30-2)12-17(13-24(25)31-3)11-19(14-27)26-28-22(15-33-26)21-10-6-8-18-7-4-5-9-20(18)21/h4-13,15H,1-3H3/b19-11+
InChIKey
FMYNTSUNURULDQ-YBFXNURJSA-N
Synonyms
683250-64-8
(4((E)2CYANO2(4NAPHTHALEN1YL13THIAZOL2YL)ETHENYL)26DIMETHOXYPHENYL)ACETATE
(E)4(2cyano2(4(naphthalen1yl)thiazol2yl)vinyl)26dimethoxyphenylacetate
4((E)2cyano2(4(naphthalen1yl)13thiazol2yl)ethenyl)26dimethoxyphenylacetate
683250648
CC(=O)OC1=C(C=C(C=C1OC)C=C(C#N)C2=NC(=CS2)C3=CC=CC4=CC=CC=C43)OC
InChI=1SC26H20N2O4Sc116(29)322523(302)1217(1324(25)313)1119(1427)262822(153326)21106818745920(18)21h41315H13H3b1911+
MFCD03671290
N#CC(=Cc1cc(OC)c(c(c1)OC)OC(=O)C)c1scc(n1)c1cccc2c1cccc2
ZINC000009013954
ZINC09013954
ZINC9013954

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Available files

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