Vitas-M small molecule compound

(2E)-3-{3-bromo-4-[(2,4-dichlorobenzyl)oxy]-5-ethoxyphenyl}-2-(4-nitrophenyl)prop-2-enenitrile

Catalog ID
STL484933
SMILES CCOc1cc(/C=C(\c2ccc(cc2)[N+](=O)[O-])/C#N)cc(c1OCc1ccc(cc1Cl)Cl)Br

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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 C24H17BrCl2N2O4 MW 548.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17BrCl2N2O4/c1-2-32-23-11-15(9-18(13-28)16-4-7-20(8-5-16)29(30)31)10-21(25)24(23)33-14-17-3-6-19(26)12-22(17)27/h3-12H,2,14H2,1H3/b18-9-
InChIKey
UDHKHIHAHMAFRA-NVMNQCDNSA-N
Synonyms

(2E)3(3bromo4((24dichlorobenzyl)oxy)5ethoxyphenyl)2(4nitrophenyl)prop2enenitrile
(2E)3(4((24DICHLOROPHENYL)METHOXY)3BROMO5ETHOXYPHENYL)2(4NITROPHENYL)PROP2ENENITRILE
(E)3(3bromo4((24dichlorophenyl)methoxy)5ethoxyphenyl)2(4nitrophenyl)prop2enenitrile
CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=C(C=C2)(N+)(=O)(O))Br)OCC3=C(C=C(C=C3)Cl)Cl
CCOc1cc(C=C(c2ccc(cc2)(N+)(=O)(O))C#N)cc(c1OCc1ccc(cc1Cl)Cl)Br
InChI=1SC24H17BrCl2N2O4c1232231115(918(1328)164720(8516)29(30)31)1021(25)24(23)3314173619(26)1222(17)27h312H214H21H3b189
MFCD01442842
ZINC000100232912
ZINC100232912

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Available files

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