Vitas-M small molecule compound
4-[(E)-2-{4-[(4-bromobenzyl)oxy]-3-ethoxyphenyl}-1-cyanoethenyl]benzonitrile
Catalog ID
STK293117
SMILES CCOc1cc(ccc1OCc1ccc(cc1)Br)/C=C(\c1ccc(cc1)C#N)/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 C25H19BrN2O2 MW 459.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19BrN2O2/c1-2-29-25-14-20(13-22(16-28)21-8-3-18(15-27)4-9-21)7-12-24(25)30-17-19-5-10-23(26)11-6-19/h3-14H,2,17H2,1H3/b22-13-InChIKey
PMWIAPHZGCALTF-XKZIYDEJSA-NSynonyms
4((E)2(4((4BROMOBENZYL)OXY)3ETHOXYPHENYL)1CYANOETHENYL)BENZONITRILE
4((E)2(4((4BROMOPHENYL)METHOXY)3ETHOXYPHENYL)1CYANOETHENYL)BENZONITRILE
CCOC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C#N)OCC3=CC=C(C=C3)Br
CCOc1cc(ccc1OCc1ccc(cc1)Br)C=C(c1ccc(cc1)C#N)C#N
InChI=1SC25H19BrN2O2c1229251420(1322(1628)218318(1527)4921)71224(25)30171951023(26)11619h314H217H21H3b2213
MFCD05801846
ZINC000016382993
ZINC16382993
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