Vitas-M small molecule compound
(2E)-3-(5-bromo-2,3-dimethoxyphenyl)-2-cyano-N-cyclohexylprop-2-enamide
Catalog ID
STK064566
SMILES N#C/C(=C\c1cc(Br)cc(c1OC)OC)/C(=O)NC1CCCCC1
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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/c1-23-16-10-14(19)9-12(17(16)24-2)8-13(11-20)18(22)21-15-6-4-3-5-7-15/h8-10,15H,3-7H2,1-2H3,(H,21,22)/b13-8+InChIKey
IGRVNTBSWQMKOE-MDWZMJQESA-NSynonyms
(2E)3(5BROMO23DIMETHOXYPHENYL)2CYANONCYCLOHEXYLPROP2ENAMIDE
(E)3(5BROMO23DIMETHOXYPHENYL)2CYANONCYCLOHEXYLPROP2ENAMIDE
COC1=C(C(=CC(=C1)Br)C=C(C#N)C(=O)NC2CCCCC2)OC
InChI=1SC18H21BrN2O3c123161014(19)912(17(16)242)813(1120)18(22)21156435715h81015H37H212H3(H2122)b138+
MFCD02196911
N#CC(=Cc1cc(Br)cc(c1OC)OC)C(=O)NC1CCCCC1
STK064566
ZINC000013897497
ZINC13897497
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