Vitas-M small molecule compound

N-(4-bromo-2-fluorophenyl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide

Catalog ID
STK781775
SMILES O=C(Cn1nc(c(c1C)I)C)Nc1ccc(cc1F)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 C13H12BrFIN3O MW 452.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12BrFIN3O/c1-7-13(16)8(2)19(18-7)6-12(20)17-11-4-3-9(14)5-10(11)15/h3-5H,6H2,1-2H3,(H,17,20)
InChIKey
NWZDQKCZHULKGU-UHFFFAOYSA-N
Synonyms

CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2)Br)F)C)I
InChI=1SC13H12BrFIN3Oc1713(16)8(2)19(187)612(20)1711439(14)510(11)15h35H6H212H3(H1720)
MFCD06016024
N(4bromo2fluorophenyl)2(4iodo35dimethyl1Hpyrazol1yl)acetamide
N(4BROMO2FLUOROPHENYL)2(4IODO35DIMETHYLPYRAZOL1YL)ACETAMIDE
ZINC000012372168
ZINC12372168

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Available files

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