Vitas-M small molecule compound
(2E)-3-(3-bromo-4-fluorophenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Catalog ID
STK287189
SMILES N#C/C(=C\c1ccc(c(c1)Br)F)/c1[nH]c2c(n1)cc(c(c2)C)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 C18H13BrFN3 MW 370.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrFN3/c1-10-5-16-17(6-11(10)2)23-18(22-16)13(9-21)7-12-3-4-15(20)14(19)8-12/h3-8H,1-2H3,(H,22,23)/b13-7+InChIKey
OPKZKHFVYVDOBO-NTUHNPAUSA-NSynonyms
(2E)3(3bromo4fluorophenyl)2(56dimethyl1Hbenzimidazol2yl)prop2enenitrile
(E)3(3BROMO4FLUOROPHENYL)2(56DIMETHYL1HBENZIMIDAZOL2YL)PROP2ENENITRILE
CC1=CC2=C(C=C1C)N=C(N2)C(=CC3=CC(=C(C=C3)F)Br)C#N
InChI=1SC18H13BrFN3c11051617(611(10)2)2318(2216)13(921)7123415(20)14(19)812h38H12H3(H2223)b137+
MFCD06632137
N#CC(=Cc1ccc(c(c1)Br)F)c1(nH)c2c(n1)cc(c(c2)C)C
ZINC000004821022
ZINC04821022
ZINC4821022
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