Vitas-M small molecule compound
(4Z)-4-(3,4-diethoxy-5-iodobenzylidene)-2-(3-nitrophenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STK546295
SMILES CCOc1cc(/C=C/2\N=C(OC2=O)c2cccc(c2)[N+](=O)[O-])cc(c1OCC)I
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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 C20H17IN2O6 MW 508.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17IN2O6/c1-3-27-17-10-12(8-15(21)18(17)28-4-2)9-16-20(24)29-19(22-16)13-6-5-7-14(11-13)23(25)26/h5-11H,3-4H2,1-2H3/b16-9-InChIKey
SEXMJIBGOHSLAH-SXGWCWSVSA-NSynonyms
(4Z)4((34DIETHOXY5IODOPHENYL)METHYLIDENE)2(3NITROPHENYL)13OXAZOL5ONE
(4Z)4(34diethoxy5iodobenzylidene)2(3nitrophenyl)13oxazol5(4H)one
(Z)4(34diethoxy5iodobenzylidene)2(3nitrophenyl)oxazol5(4H)one
CCOC1=C(C(=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=CC=C3)(N+)(=O)(O))I)OCC
CCOc1cc(C=C2N=C(OC2=O)c2cccc(c2)(N+)(=O)(O))cc(c1OCC)I
InChI=1SC20H17IN2O6c1327171012(815(21)18(17)2842)91620(24)2919(2216)1365714(1113)23(25)26h511H34H212H3b169
MFCD01138711
ZINC000002312849
ZINC02312849
ZINC2312849
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