Vitas-M small molecule compound

(4-bromophenyl)(3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)acetonitrile

Catalog ID
STK125043
SMILES N#CC(c1ccc(cc1)Br)N1CCC(=N1)c1ccccc1

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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 C17H14BrN3 MW 340.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14BrN3/c18-15-8-6-14(7-9-15)17(12-19)21-11-10-16(20-21)13-4-2-1-3-5-13/h1-9,17H,10-11H2
InChIKey
NYLITHJIOLXLBE-UHFFFAOYSA-N
Synonyms

(2S)(4BROMOPHENYL)(3PHENYL45DIHYDRO1HPYRAZOL1YL)ETHANENITRILE
(4BROMOPHENYL)(3PHENYL45DIHYDRO1HPYRAZOL1YL)ACETONITRILE
2(4BROMOPHENYL)2(5PHENYL34DIHYDROPYRAZOL2YL)ACETONITRILE
C1CN(N=C1C2=CC=CC=C2)C(C#N)C3=CC=C(C=C3)Br
InChI=1SC17H14BrN3c18158614(7915)17(1219)21111016(2021)134213513h1917H1011H2
MFCD05258189
ZINC000001441936
ZINC000001441938

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Available files

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