Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-(5-bromo-2,4-dimethoxyphenyl)prop-2-enenitrile
Catalog ID
STK297135
SMILES COc1cc(OC)c(cc1/C=C(/c1nc2c([nH]1)cccc2)\C#N)Br
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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 C18H14BrN3O2 MW 384.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14BrN3O2/c1-23-16-9-17(24-2)13(19)8-11(16)7-12(10-20)18-21-14-5-3-4-6-15(14)22-18/h3-9H,1-2H3,(H,21,22)/b12-7+InChIKey
KHERVOIPAHBTPJ-KPKJPENVSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(5bromo24dimethoxyphenyl)prop2enenitrile
(E)2(1HBENZIMIDAZOL2YL)3(5BROMO24DIMETHOXYPHENYL)PROP2ENENITRILE
COC1=CC(=C(C=C1C=C(C#N)C2=NC3=CC=CC=C3N2)Br)OC
COc1cc(OC)c(cc1C=C(c1nc2c((nH)1)cccc2)C#N)Br
InChI=1SC18H14BrN3O2c12316917(242)13(19)811(16)712(1020)182114534615(14)2218h39H12H3(H2122)b127+
MFCD07178554
ZINC000017078409
ZINC17078409
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