Vitas-M small molecule compound
{4-[(4-bromobenzyl)oxy]-3-methoxy-5-(prop-2-en-1-yl)benzylidene}propanedinitrile
Catalog ID
STK136565
SMILES C=CCc1cc(C=C(C#N)C#N)cc(c1OCc1ccc(cc1)Br)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 C21H17BrN2O2 MW 409.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN2O2/c1-3-4-18-10-16(9-17(12-23)13-24)11-20(25-2)21(18)26-14-15-5-7-19(22)8-6-15/h3,5-11H,1,4,14H2,2H3InChIKey
CWVLRYBWCNQMCG-UHFFFAOYSA-NSynonyms
(4((4BROMOBENZYL)OXY)3METHOXY5(PROP2EN1YL)BENZYLIDENE)PROPANEDINITRILE
2((4((4BROMOPHENYL)METHOXY)3METHOXY5PROP2ENYLPHENYL)METHYLIDENE)PROPANEDINITRILE
COC1=CC(=CC(=C1OCC2=CC=C(C=C2)Br)CC=C)C=C(C#N)C#N
InChI=1SC21H17BrN2O2c134181016(917(1223)1324)1120(252)21(18)2614155719(22)8615h3511H1414H22H3
MFCD05800787
ZINC000004681253
ZINC04681253
ZINC4681253
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