Vitas-M small molecule compound
(2E)-3-[2-bromo-5-methoxy-4-(prop-2-yn-1-yloxy)phenyl]-2-cyano-N-phenylprop-2-enamide
Catalog ID
STK182977
SMILES COc1cc(/C=C(/C(=O)Nc2ccccc2)\C#N)c(cc1OCC#C)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 C20H15BrN2O3 MW 411.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrN2O3/c1-3-9-26-19-12-17(21)14(11-18(19)25-2)10-15(13-22)20(24)23-16-7-5-4-6-8-16/h1,4-8,10-12H,9H2,2H3,(H,23,24)/b15-10+InChIKey
AORYDYPVFOUPNW-XNTDXEJSSA-NSynonyms
(2E)3(2BROMO5METHOXY4(PROP2YN1YLOXY)PHENYL)2CYANONPHENYLPROP2ENAMIDE
(E)3(2BROMO5METHOXY4PROP2YNOXYPHENYL)2CYANONPHENYLPROP2ENAMIDE
COC1=C(C=C(C(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2)Br)OCC#C
COc1cc(C=C(C(=O)Nc2ccccc2)C#N)c(cc1OCC#C)Br
InChI=1SC20H15BrN2O3c13926191217(21)14(1118(19)252)1015(1322)20(24)23167546816h1481012H9H22H3(H2324)b1510+
MFCD04308042
ZINC000004723182
ZINC04723182
ZINC4723182
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