Vitas-M small molecule compound
(2E)-3-(2-bromo-4,5-dimethoxyphenyl)-2-cyano-N-cyclohexylprop-2-enamide
Catalog ID
STL367609
SMILES COc1cc(/C=C(/C(=O)NC2CCCCC2)\C#N)c(cc1OC)Br
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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 C18H21BrN2O3 MW 393.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21BrN2O3/c1-23-16-9-12(15(19)10-17(16)24-2)8-13(11-20)18(22)21-14-6-4-3-5-7-14/h8-10,14H,3-7H2,1-2H3,(H,21,22)/b13-8+InChIKey
ODVLHSJILIPKDG-MDWZMJQESA-NSynonyms
(2E)3(2bromo45dimethoxyphenyl)2cyanoNcyclohexylprop2enamide
(E)3(2BROMO45DIMETHOXYPHENYL)2CYANONCYCLOHEXYLPROP2ENAMIDE
COC1=C(C=C(C(=C1)C=C(C#N)C(=O)NC2CCCCC2)Br)OC
COc1cc(C=C(C(=O)NC2CCCCC2)C#N)c(cc1OC)Br
InChI=1SC18H21BrN2O3c12316912(15(19)1017(16)242)813(1120)18(22)21146435714h81014H37H212H3(H2122)b138+
MFCD01801112
ZINC000003614260
ZINC03614260
ZINC3614260
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