Vitas-M small molecule compound
[4-{(E)-[1-(3,5-dimethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-ethoxy-6-(prop-2-en-1-yl)phenoxy]acetic acid
Catalog ID
STK170703
SMILES CCOc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)c2cc(C)cc(c2)C)cc(c1OCC(=O)O)CC=C
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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 C26H26N2O7 MW 478.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O7/c1-5-7-18-11-17(13-21(34-6-2)23(18)35-14-22(29)30)12-20-24(31)27-26(33)28(25(20)32)19-9-15(3)8-16(4)10-19/h5,8-13H,1,6-7,14H2,2-4H3,(H,29,30)(H,27,31,33)/b20-12+InChIKey
OAOWOJLWEZHCCY-UDWIEESQSA-NSynonyms
(4((E)(1(35DIMETHYLPHENYL)246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2ETHOXY6(PROP2EN1YL)PHENOXY)ACETICACID
2(4((E)(1(35DIMETHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)2ETHOXY6PROP2ENYLPHENOXY)ACETICACID
CCOC1=CC(=CC(=C1OCC(=O)O)CC=C)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC(=C3)C)C
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2cc(C)cc(c2)C)cc(c1OCC(=O)O)CC=C
InChI=1SC26H26N2O7c157181117(1321(3462)23(18)351422(29)30)122024(31)2726(33)28(25(20)32)19915(3)816(4)1019h5813H16714H224H3(H2930)(H273133)b2012+
MFCD02108390
ZINC000009311100
ZINC9311100
Check stock
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Check stock on Vitas-MAvailable files
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