Vitas-M small molecule compound
(2E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-enamide
Catalog ID
STK472864
SMILES N#C/C(=C\c1ccc(c(c1)COc1ccccc1)OC)/C(=O)Nc1ccc2c(c1)OCCO2
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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 C26H22N2O5 MW 442.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O5/c1-30-23-9-7-18(14-20(23)17-33-22-5-3-2-4-6-22)13-19(16-27)26(29)28-21-8-10-24-25(15-21)32-12-11-31-24/h2-10,13-15H,11-12,17H2,1H3,(H,28,29)/b19-13+InChIKey
XREZAFDIZJPPJZ-CPNJWEJPSA-NSynonyms
(2E)2cyanoN(23dihydro14benzodioxin6yl)3(4methoxy3(phenoxymethyl)phenyl)prop2enamide
(2E)N(2H3HBENZO(34E)14DIOXAN6YL)2CYANO3(4METHOXY3(PHENOXYMETHYL)PHENYL)PROP2ENAMIDE
(E)2cyanoN(23dihydro14benzodioxin6yl)3(4methoxy3(phenoxymethyl)phenyl)prop2enamide
COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC3=C(C=C2)OCCO3)COC4=CC=CC=C4
InChI=1SC26H22N2O5c130239718(1420(23)1733225324622)1319(1627)26(29)28218102425(1521)3212113124h2101315H111217H21H3(H2829)b1913+
MFCD07092784
N#CC(=Cc1ccc(c(c1)COc1ccccc1)OC)C(=O)Nc1ccc2c(c1)OCCO2
ZINC000019635815
ZINC19635815
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