Vitas-M small molecule compound
(4E)-4-{3-ethoxy-5-iodo-4-[(2-methylbenzyl)oxy]benzylidene}-2-(3-methylphenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STL171345
SMILES CCOc1cc(/C=C\2/N=C(OC2=O)c2cccc(c2)C)cc(c1OCc1ccccc1C)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 C27H24INO4 MW 553.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24INO4/c1-4-31-24-15-19(13-22(28)25(24)32-16-21-10-6-5-9-18(21)3)14-23-27(30)33-26(29-23)20-11-7-8-17(2)12-20/h5-15H,4,16H2,1-3H3/b23-14+InChIKey
SYOKBCKJEGQOFU-OEAKJJBVSA-NSynonyms
354995-88-3(4E)4((3ETHOXY5IODO4((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)2(3METHYLPHENYL)13OXAZOL5ONE
(4E)4(3ethoxy5iodo4((2methylbenzyl)oxy)benzylidene)2(3methylphenyl)13oxazol5(4H)one
354995883
4(3ETHOXY5IODO4((2METHYLBENZYL)OXY)BENZYLIDENE)2(3METHYLPHENYL)13OXAZOL5(4H)ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=CC=C3)C)I)OCC4=CC=CC=C4C
CCOc1cc(C=C2N=C(OC2=O)c2cccc(c2)C)cc(c1OCc1ccccc1C)I
InChI=1SC27H24INO4c1431241519(1322(28)25(24)3216211065918(21)3)142327(30)3326(2923)20117817(2)1220h515H416H213H3b2314+
MFCD01447250
ZINC000002082312
ZINC02082312
ZINC2082312
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