Vitas-M small molecule compound

(2Z)-3-(3-{3-[(2-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Catalog ID
STK707291
SMILES N#C/C(=C/c1cn(nc1c1cccc(c1)OCc1ccccc1F)c1ccccc1)/c1nc2c(n1C)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 C33H24FN5O MW 525.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H24FN5O/c1-38-31-17-8-7-16-30(31)36-33(38)25(20-35)18-26-21-39(27-12-3-2-4-13-27)37-32(26)23-11-9-14-28(19-23)40-22-24-10-5-6-15-29(24)34/h2-19,21H,22H2,1H3/b25-18-
InChIKey
IFGIZIDZZLCRNT-BWAHOGKJSA-N
Synonyms

(2Z)3(3(3((2fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2(1methyl1Hbenzimidazol2yl)prop2enenitrile
(E)3(3(3((2fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2(1methyl1Hbenzo(d)imidazol2yl)acrylonitrile
(Z)3(3(3((2fluorophenyl)methoxy)phenyl)1phenylpyrazol4yl)2(1methylbenzimidazol2yl)prop2enenitrile
CN1C2=CC=CC=C2N=C1C(=CC3=CN(N=C3C4=CC(=CC=C4)OCC5=CC=CC=C5F)C6=CC=CC=C6)C#N
InChI=1SC33H24FN5Oc1383117871630(31)3633(38)25(2035)18262139(27123241327)3732(26)231191428(1923)40222410561529(24)34h21921H22H21H3b2518
MFCD13371191
N#CC(=Cc1cn(nc1c1cccc(c1)OCc1ccccc1F)c1ccccc1)c1nc2c(n1C)cccc2
ZINC000097947299
ZINC97947299

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Available files

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