Vitas-M small molecule compound
(2E)-3-(3-bromo-5-ethoxy-4-propoxyphenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Catalog ID
STK287161
SMILES CCCOc1c(Br)cc(cc1OCC)/C=C(/c1[nH]c2c(n1)cc(c(c2)C)C)\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 C23H24BrN3O2 MW 454.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24BrN3O2/c1-5-7-29-22-18(24)11-16(12-21(22)28-6-2)10-17(13-25)23-26-19-8-14(3)15(4)9-20(19)27-23/h8-12H,5-7H2,1-4H3,(H,26,27)/b17-10+InChIKey
DDEMEFPYZBUKEB-LICLKQGHSA-NSynonyms
(2E)3(3bromo5ethoxy4propoxyphenyl)2(56dimethyl1Hbenzimidazol2yl)prop2enenitrile
(E)3(3BROMO5ETHOXY4PROPOXYPHENYL)2(56DIMETHYL1HBENZIMIDAZOL2YL)PROP2ENENITRILE
CCCOC1=C(C=C(C=C1Br)C=C(C#N)C2=NC3=C(N2)C=C(C(=C3)C)C)OCC
CCCOc1c(Br)cc(cc1OCC)C=C(c1(nH)c2c(n1)cc(c(c2)C)C)C#N
InChI=1SC23H24BrN3O2c157292218(24)1116(1221(22)2862)1017(1325)232619814(3)15(4)920(19)2723h812H57H214H3(H2627)b1710+
MFCD07437597
ZINC000009187454
ZINC09187454
ZINC9187454
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