Vitas-M small molecule compound
(2E)-3-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-ethoxyphenyl)-2-cyanoprop-2-enamide
Catalog ID
STK385517
SMILES CCOc1cc(/C=C(/C(=O)N)\C#N)cc(c1OCCOc1ccc(cc1)C(CC)C)Cl
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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 C24H27ClN2O4 MW 442.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClN2O4/c1-4-16(3)18-6-8-20(9-7-18)30-10-11-31-23-21(25)13-17(14-22(23)29-5-2)12-19(15-26)24(27)28/h6-9,12-14,16H,4-5,10-11H2,1-3H3,(H2,27,28)/b19-12+InChIKey
DNIOUJWCXWOGSG-XDHOZWIPSA-NSynonyms
(2E)3(4(2(4(BUTAN2YL)PHENOXY)ETHOXY)3CHLORO5ETHOXYPHENYL)2CYANOPROP2ENAMIDE
(E)3(4(2(4BUTAN2YLPHENOXY)ETHOXY)3CHLORO5ETHOXYPHENYL)2CYANOPROP2ENAMIDE
CCC(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Cl)C=C(C#N)C(=O)N)OCC
CCOc1cc(C=C(C(=O)N)C#N)cc(c1OCCOc1ccc(cc1)C(CC)C)Cl
InChI=1SC24H27ClN2O4c1416(3)186820(9718)301011312321(25)1317(1422(23)2952)1219(1526)24(27)28h69121416H451011H213H3(H22728)b1912+
MFCD02188848
ZINC000016158121
ZINC000016158124
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