Vitas-M small molecule compound
(2Z)-3-{3-bromo-4-[(4-fluorobenzyl)oxy]phenyl}-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Catalog ID
STK201512
SMILES N#C/C(=C/c1ccc(c(c1)Br)OCc1ccc(cc1)F)/c1nc2c([nH]1)ccc(c2)C
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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 C24H17BrFN3O MW 462.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17BrFN3O/c1-15-2-8-21-22(10-15)29-24(28-21)18(13-27)11-17-5-9-23(20(25)12-17)30-14-16-3-6-19(26)7-4-16/h2-12H,14H2,1H3,(H,28,29)/b18-11-InChIKey
DDMITAPMUMHYHH-WQRHYEAKSA-NSynonyms
(2Z)3(3BROMO4((4FLUOROBENZYL)OXY)PHENYL)2(5METHYL1HBENZIMIDAZOL2YL)PROP2ENENITRILE
(Z)3(3BROMO4((4FLUOROPHENYL)METHOXY)PHENYL)2(6METHYL1HBENZIMIDAZOL2YL)PROP2ENENITRILE
CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C=C3)OCC4=CC=C(C=C4)F)Br)C#N
InChI=1SC24H17BrFN3Oc115282122(1015)2924(2821)18(1327)11175923(20(25)1217)3014163619(26)7416h212H14H21H3(H2829)b1811
MFCD05997583
N#CC(=Cc1ccc(c(c1)Br)OCc1ccc(cc1)F)c1nc2c((nH)1)ccc(c2)C
ZINC000009934908
ZINC09934908
ZINC9934908
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