Vitas-M small molecule compound
(2E)-2-cyano-N-cyclohexyl-3-{4-[(3,4-dichlorobenzyl)oxy]-3-ethoxyphenyl}prop-2-enamide
Catalog ID
STK057261
SMILES CCOc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)/C=C(/C(=O)NC1CCCCC1)\C#N
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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 C25H26Cl2N2O3 MW 473.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26Cl2N2O3/c1-2-31-24-14-17(12-19(15-28)25(30)29-20-6-4-3-5-7-20)9-11-23(24)32-16-18-8-10-21(26)22(27)13-18/h8-14,20H,2-7,16H2,1H3,(H,29,30)/b19-12+InChIKey
TYVNZHFBMQBXBR-XDHOZWIPSA-NSynonyms
(2E)2CYANONCYCLOHEXYL3(4((34DICHLOROBENZYL)OXY)3ETHOXYPHENYL)PROP2ENAMIDE
(E)2CYANONCYCLOHEXYL3(4((34DICHLOROPHENYL)METHOXY)3ETHOXYPHENYL)PROP2ENAMIDE
CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2CCCCC2)OCC3=CC(=C(C=C3)Cl)Cl
CCOc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)C=C(C(=O)NC1CCCCC1)C#N
InChI=1SC25H26Cl2N2O3c1231241417(1219(1528)25(30)29206435720)91123(24)32161881021(26)22(27)1318h81420H2716H21H3(H2930)b1912+
MFCD02196929
STK057261
ZINC000009261806
ZINC09261806
ZINC9261806
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