Vitas-M small molecule compound
(4E)-4-(3-bromo-5-ethoxy-4-propoxybenzylidene)-2-(2-methylphenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STK957177
SMILES CCCOc1c(Br)cc(cc1OCC)/C=C\1/N=C(OC1=O)c1ccccc1C
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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 C22H22BrNO4 MW 444.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrNO4/c1-4-10-27-20-17(23)11-15(13-19(20)26-5-2)12-18-22(25)28-21(24-18)16-9-7-6-8-14(16)3/h6-9,11-13H,4-5,10H2,1-3H3/b18-12+InChIKey
LOMKBUZBYNLDKX-LDADJPATSA-NSynonyms
353468-73-2(4E)4((3BROMO5ETHOXY4PROPOXYPHENYL)METHYLIDENE)2(2METHYLPHENYL)13OXAZOL5ONE
(4E)4(3bromo5ethoxy4propoxybenzylidene)2(2methylphenyl)13oxazol5(4H)one
353468732
4(3BROMO5ETHOXY4PROPOXYBENZYLIDENE)2(2METHYLPHENYL)13OXAZOL5(4H)ONE
CCCOC1=C(C=C(C=C1Br)C=C2C(=O)OC(=N2)C3=CC=CC=C3C)OCC
CCCOc1c(Br)cc(cc1OCC)C=C1N=C(OC1=O)c1ccccc1C
InChI=1SC22H22BrNO4c1410272017(23)1115(1319(20)2652)121822(25)2821(2418)16976814(16)3h691113H4510H213H3b1812+
MFCD01417328
ZINC000002081281
ZINC02081281
ZINC2081281
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