Vitas-M small molecule compound

4-{(E)-1-cyano-2-[5-methoxy-2-(prop-2-yn-1-yloxy)phenyl]ethenyl}benzonitrile

Catalog ID
STK293095
SMILES C#CCOc1ccc(cc1/C=C(\c1ccc(cc1)C#N)/C#N)OC

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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 C20H14N2O2 MW 314.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N2O2/c1-3-10-24-20-9-8-19(23-2)12-17(20)11-18(14-22)16-6-4-15(13-21)5-7-16/h1,4-9,11-12H,10H2,2H3/b18-11-
InChIKey
MISRPRBNVXBJPE-WQRHYEAKSA-N
Synonyms

4((E)1CYANO2(5METHOXY2(PROP2YN1YLOXY)PHENYL)ETHENYL)BENZONITRILE
4((E)1CYANO2(5METHOXY2PROP2YNOXYPHENYL)ETHENYL)BENZONITRILE
C#CCOc1ccc(cc1C=C(c1ccc(cc1)C#N)C#N)OC
COC1=CC(=C(C=C1)OCC#C)C=C(C#N)C2=CC=C(C=C2)C#N
InChI=1SC20H14N2O2c131024209819(232)1217(20)1118(1422)166415(1321)5716h1491112H10H22H3b1811
MFCD05801761
ZINC000016382982
ZINC16382982

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Available files

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