Vitas-M small molecule compound

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

Catalog ID
STK124753
SMILES N#CC(N1CCC(=N1)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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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 C17H14N4O2 MW 306.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4O2/c18-12-17(14-6-8-15(9-7-14)21(22)23)20-11-10-16(19-20)13-4-2-1-3-5-13/h1-9,17H,10-11H2
InChIKey
BEEIZBGSHDWAAJ-UHFFFAOYSA-N
Synonyms

(4NITROPHENYL)(3PHENYL45DIHYDRO1HPYRAZOL1YL)ACETONITRILE
2(4nitrophenyl)2(3phenyl45dihydro1Hpyrazol1yl)acetonitrile
2(4NITROPHENYL)2(5PHENYL34DIHYDROPYRAZOL2YL)ACETONITRILE
C1CN(N=C1C2=CC=CC=C2)C(C#N)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC17H14N4O2c181217(146815(9714)21(22)23)20111016(1920)134213513h1917H1011H2
MFCD02986024
N#CC(N1CCC(=N1)c1ccccc1)c1ccc(cc1)(N+)(=O)(O)
ZINC000000509384
ZINC000000509386

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Available files

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