Vitas-M small molecule compound
(2E)-3-(2-bromo-4,5-dimethoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile
Catalog ID
STL484931
SMILES N#C/C(=C/c1cc(OC)c(cc1Br)OC)/c1ccc(cc1)Cl
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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 C17H13BrClNO2 MW 378.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrClNO2/c1-21-16-8-12(15(18)9-17(16)22-2)7-13(10-20)11-3-5-14(19)6-4-11/h3-9H,1-2H3/b13-7-InChIKey
NJFNYAXSRAQWSY-QPEQYQDCSA-NSynonyms
(2E)3(2bromo45dimethoxyphenyl)2(4chlorophenyl)prop2enenitrile
(E)3(2bromo45dimethoxyphenyl)2(4chlorophenyl)prop2enenitrile
COC1=C(C=C(C(=C1)C=C(C#N)C2=CC=C(C=C2)Cl)Br)OC
InChI=1SC17H13BrClNO2c12116812(15(18)917(16)222)713(1020)113514(19)6411h39H12H3b137
MFCD30713740
N#CC(=Cc1cc(OC)c(cc1Br)OC)c1ccc(cc1)Cl
ZINC000006169916
ZINC6169916
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