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ethyl ({(4E)-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-1-phenyl-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
SpectraBase Compound ID 7nxP343ZFw4
InChI InChI=1S/C18H18N4O3S/c1-3-25-16(23)12-26-18-20-15(9-13-10-19-21(2)11-13)17(24)22(18)14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3/b15-9+
InChIKey PUJYTBAUJNZBSY-OQLLNIDSSA-N
Mol Weight 370.43 g/mol
Molecular Formula C18H18N4O3S
Exact Mass 370.109962 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JLxo3PeMGzm
Name ethyl ({(4E)-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-1-phenyl-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C18H18N4O3S/c1-3-25-16(23)12-26-18-20-15(9-13-10-19-21(2)11-13)17(24)22(18)14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3/b15-9+
InChIKey PUJYTBAUJNZBSY-OQLLNIDSSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11561
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/1266617; Labnumber: NIV1591; UZI_ID: UZI-011563
Synonyms ethyl ({4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-1-phenyl-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetate
Temperature 308 °C