Vitas-M small molecule compound
(4Z)-4-(3-bromo-4,5-diethoxybenzylidene)-2-(2-chloro-4-nitrophenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STK535692
SMILES CCOc1cc(/C=C/2\N=C(OC2=O)c2ccc(cc2Cl)[N+](=O)[O-])cc(c1OCC)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 C20H16BrClN2O6 MW 495.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrClN2O6/c1-3-28-17-9-11(7-14(21)18(17)29-4-2)8-16-20(25)30-19(23-16)13-6-5-12(24(26)27)10-15(13)22/h5-10H,3-4H2,1-2H3/b16-8-InChIKey
XUDYZVXDEXJWPE-PXNMLYILSA-NSynonyms
(4Z)4((3BROMO45DIETHOXYPHENYL)METHYLIDENE)2(2CHLORO4NITROPHENYL)13OXAZOL5ONE
(4Z)4(3bromo45diethoxybenzylidene)2(2chloro4nitrophenyl)13oxazol5(4H)one
(Z)4(3bromo45diethoxybenzylidene)2(2chloro4nitrophenyl)oxazol5(4H)one
4((3BROMO45DIETHOXYPHENYL)METHYLENE)2(2CHLORO4NITROPHENYL)13OXAZOLIN5ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)OC(=N2)C3=C(C=C(C=C3)(N+)(=O)(O))Cl)Br)OCC
CCOc1cc(C=C2N=C(OC2=O)c2ccc(cc2Cl)(N+)(=O)(O))cc(c1OCC)Br
InChI=1SC20H16BrClN2O6c132817911(714(21)18(17)2942)81620(25)3019(2316)136512(24(26)27)1015(13)22h510H34H212H3b168
MFCD01138730
ZINC000001792663
ZINC01792663
ZINC1792663
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