1-({[3-(4-Chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}amino)-4-(4-methylphenyl)tetrahydro-2,5-pyrazinedione

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Systematic / IUPAC Name: 1-[(E)-{[3-(4-Chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}amino]-4-(4-methylphenyl)-2,5-piperazinedione

ID: Reference3821

Other Names: 2,5-Piperazinedione, 1-({(1E)-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}amino)-4-(4-methylphenyl)-

Formula: C27H22ClN5O2

Spectral Data

1-({[3-(4-Chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}amino)-4-(4-methylphenyl)tetrahydro-2,5-pyrazinedione mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/15/2016 8:24:59 AM
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Identificators

InChI InChI=1S/C27H22ClN5O2/c1-19-7-13-23(14-8-19)31-17-26(35)33(18-25(31)34)29-15-21-16-32(24-5-3-2-4-6-24)30-27(21)20-9-11-22(28)12-10-20/h2-16H,17-18H2,1H3/b29-15+
InChI Key NGYKAUYSNYJQEW-WKULSOCRSA-N
Canonical SMILES CC1=CC=C(C=C1)N2CC(=O)N(CC2=O)N=CC3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5
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Other Names 2,5-Piperazinedione, 1-({(1E)-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}amino)-4-(4-methylphenyl)-

In Other Databases

PubChem 9584008
ChemSpider 7858155