Vitas-M small molecule compound
4-[(Z)-2-(6-bromo-1,3-benzodioxol-5-yl)-1-cyanoethenyl]benzonitrile
Catalog ID
STK293159
SMILES N#C/C(=C\c1cc2OCOc2cc1Br)/c1ccc(cc1)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 C17H9BrN2O2 MW 353.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9BrN2O2/c18-15-7-17-16(21-10-22-17)6-13(15)5-14(9-20)12-3-1-11(8-19)2-4-12/h1-7H,10H2/b14-5+InChIKey
YFWNNKZCBKSVPA-LHHJGKSTSA-NSynonyms
4((Z)2(6BROMO13BENZODIOXOL5YL)1CYANOETHENYL)BENZONITRILE
C1OC2=C(O1)C=C(C(=C2)C=C(C#N)C3=CC=C(C=C3)C#N)Br
InChI=1SC17H9BrN2O2c181571716(21102217)613(15)514(920)123111(819)2412h17H10H2b145+
MFCD05801982
N#CC(=Cc1cc2OCOc2cc1Br)c1ccc(cc1)C#N
ZINC000001075976
ZINC01075976
ZINC1075976
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