3-(4-Phenylpiperazino)-2-(2-pyridylsulfonyl)acrylonitrile

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Systematic / IUPAC Name: (2E)-3-(4-Phenyl-1-piperazinyl)-2-(2-pyridinylsulfonyl)acrylonitrile

ID: Reference4311

Other Names: 2-Propenenitrile, 3-(4-phenyl-1-piperazinyl)-2-(2-pyridinylsulfonyl)-, (2E)-

Formula: C18H18N4O2S

Spectral Data

3-(4-Phenylpiperazino)-2-(2-pyridylsulfonyl)acrylonitrile 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 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/21/2016 10:49:31 AM
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Identificators

InChI InChI=1S/C18H18N4O2S/c19-14-17(25(23,24)18-8-4-5-9-20-18)15-21-10-12-22(13-11-21)16-6-2-1-3-7-16/h1-9,15H,10-13H2/b17-15+
InChI Key AIROITBLLQWHNV-BMRADRMJSA-N
Canonical SMILES C1CN(CCN1C=C(C#N)S(=O)(=O)C2=CC=CC=N2)C3=CC=CC=C3
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Other Names 2-Propenenitrile, 3-(4-phenyl-1-piperazinyl)-2-(2-pyridinylsulfonyl)-, (2E)-

In Other Databases

PubChem 2822713
ChemSpider 2100926