Vitas-M small molecule compound

2-{4-[(E)-2-cyano-2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethenyl]-2-methoxyphenoxy}-N-(2-fluoro-5-methylphenyl)acetamide

Catalog ID
STK285174
SMILES COc1cc(ccc1OCC(=O)Nc1cc(C)ccc1F)/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 C28H25FN4O3 MW 484.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25FN4O3/c1-16-5-7-21(29)22(9-16)31-27(34)15-36-25-8-6-19(13-26(25)35-4)12-20(14-30)28-32-23-10-17(2)18(3)11-24(23)33-28/h5-13H,15H2,1-4H3,(H,31,34)(H,32,33)/b20-12+
InChIKey
RPMHQCAYKVRFLQ-UDWIEESQSA-N
Synonyms

2(4((E)2cyano2(56dimethyl1Hbenzimidazol2yl)ethenyl)2methoxyphenoxy)N(2fluoro5methylphenyl)acetamide
CC1=CC(=C(C=C1)F)NC(=O)COC2=C(C=C(C=C2)C=C(C#N)C3=NC4=C(N3)C=C(C(=C4)C)C)OC
COc1cc(ccc1OCC(=O)Nc1cc(C)ccc1F)C=C(c1(nH)c2c(n1)cc(c(c2)C)C)C#N
InChI=1SC28H25FN4O3c1165721(29)22(916)3127(34)1536258619(1326(25)354)1220(1430)2832231017(2)18(3)1124(23)3328h513H15H214H3(H3134)(H3233)b2012+
MFCD08087415
ZINC000009187469
ZINC09187469
ZINC9187469

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Available files

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