Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-[1-(2-chloro-6-fluorobenzyl)-1H-indol-3-yl]prop-2-enenitrile
Catalog ID
STK116206
SMILES N#C/C(=C\c1cn(c2c1cccc2)Cc1c(F)cccc1Cl)/c1nc2c([nH]1)cccc2
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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 C25H16ClFN4 MW 426.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16ClFN4/c26-20-7-5-8-21(27)19(20)15-31-14-17(18-6-1-4-11-24(18)31)12-16(13-28)25-29-22-9-2-3-10-23(22)30-25/h1-12,14H,15H2,(H,29,30)/b16-12+InChIKey
OHTSYTSZIWRSLN-FOWTUZBSSA-NSynonyms
(2E)2(1HBENZIMIDAZOL2YL)3(1(2CHLORO6FLUOROBENZYL)1HINDOL3YL)PROP2ENENITRILE
(E)2(1HBENZIMIDAZOL2YL)3(1((2CHLORO6FLUOROPHENYL)METHYL)INDOL3YL)PROP2ENENITRILE
C1=CC=C2C(=C1)C(=CN2CC3=C(C=CC=C3Cl)F)C=C(C#N)C4=NC5=CC=CC=C5N4
InChI=1SC25H16ClFN4c262075821(27)19(20)15311417(186141124(18)31)1216(1328)2529229231023(22)3025h11214H15H2(H2930)b1612+
MFCD04212542
N#CC(=Cc1cn(c2c1cccc2)Cc1c(F)cccc1Cl)c1nc2c((nH)1)cccc2
ZINC000009187163
ZINC09187163
ZINC9187163
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