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N-(2,4-dichlorophenyl)-2-({(4E)-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-1-isobutyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide

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N-(2,4-dichlorophenyl)-2-({(4E)-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-1-isobutyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide
SpectraBase Compound ID FKWM6pXnJ2e
InChI InChI=1S/C21H23Cl2N5O2S/c1-12(2)9-28-20(30)18(7-14-10-27(4)26-13(14)3)25-21(28)31-11-19(29)24-17-6-5-15(22)8-16(17)23/h5-8,10,12H,9,11H2,1-4H3,(H,24,29)/b18-7+
InChIKey ZUXSKKHCZXOFDO-CNHKJKLMSA-N
Mol Weight 480.41 g/mol
Molecular Formula C21H23Cl2N5O2S
Exact Mass 479.094952 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DEOH9OfeeET
Name N-(2,4-dichlorophenyl)-2-({(4E)-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-1-isobutyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide
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/C21H23Cl2N5O2S/c1-12(2)9-28-20(30)18(7-14-10-27(4)26-13(14)3)25-21(28)31-11-19(29)24-17-6-5-15(22)8-16(17)23/h5-8,10,12H,9,11H2,1-4H3,(H,24,29)/b18-7+
InChIKey ZUXSKKHCZXOFDO-CNHKJKLMSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11497
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/1267888; Labnumber: NIV1498; UZI_ID: UZI-011499
Synonyms N-(2,4-dichlorophenyl)-2-({4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-1-isobutyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide
Temperature 313 °C