Vitas-M small molecule compound

2-(4-bromo-3,5-dimethylphenoxy)-N-(4-cyanophenyl)acetamide

Catalog ID
STK225507
SMILES N#Cc1ccc(cc1)NC(=O)COc1cc(C)c(c(c1)C)Br

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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 C17H15BrN2O2 MW 359.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN2O2/c1-11-7-15(8-12(2)17(11)18)22-10-16(21)20-14-5-3-13(9-19)4-6-14/h3-8H,10H2,1-2H3,(H,20,21)
InChIKey
IABNWWDAVWEPJA-UHFFFAOYSA-N
Synonyms

2(4bromo35dimethylphenoxy)N(4cyanophenyl)acetamide
CC1=CC(=CC(=C1Br)C)OCC(=O)NC2=CC=C(C=C2)C#N
InChI=1SC17H15BrN2O2c111715(812(2)17(11)18)221016(21)20145313(919)4614h38H10H212H3(H2021)
MFCD03992858
ZINC000001160261
ZINC01160261
ZINC1160261

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.