Vitas-M small molecule compound
(2E)-2-cyano-N-cyclohexyl-3-[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]prop-2-enamide
Catalog ID
STK364841
SMILES COc1cc(C)c(cc1C(C)C)/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 C21H28N2O2 MW 340.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O2/c1-14(2)19-12-16(15(3)10-20(19)25-4)11-17(13-22)21(24)23-18-8-6-5-7-9-18/h10-12,14,18H,5-9H2,1-4H3,(H,23,24)/b17-11+InChIKey
FZCKRQRCNGDOCE-GZTJUZNOSA-NSynonyms
(2E)2CYANONCYCLOHEXYL3(4METHOXY2METHYL5(PROPAN2YL)PHENYL)PROP2ENAMIDE
(E)2CYANONCYCLOHEXYL3(4METHOXY2METHYL5PROPAN2YLPHENYL)PROP2ENAMIDE
CC1=CC(=C(C=C1C=C(C#N)C(=O)NC2CCCCC2)C(C)C)OC
COc1cc(C)c(cc1C(C)C)C=C(C(=O)NC1CCCCC1)C#N
InChI=1SC21H28N2O2c114(2)191216(15(3)1020(19)254)1117(1322)21(24)23188657918h10121418H59H214H3(H2324)b1711+
MFCD02196988
ZINC000023382864
ZINC23382864
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