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N-(2,4-dichlorophenyl)-2-({(4E)-1-(3-methoxypropyl)-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide
SpectraBase Compound ID I368IlTat8h
InChI InChI=1S/C20H21Cl2N5O3S/c1-26-11-13(10-23-26)8-17-19(29)27(6-3-7-30-2)20(25-17)31-12-18(28)24-16-5-4-14(21)9-15(16)22/h4-5,8-11H,3,6-7,12H2,1-2H3,(H,24,28)/b17-8+
InChIKey UKYRFJQPDOPXOU-CAOOACKPSA-N
Mol Weight 482.39 g/mol
Molecular Formula C20H21Cl2N5O3S
Exact Mass 481.074216 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J9Oj2sroJq5
Name N-(2,4-dichlorophenyl)-2-({(4E)-1-(3-methoxypropyl)-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-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/C20H21Cl2N5O3S/c1-26-11-13(10-23-26)8-17-19(29)27(6-3-7-30-2)20(25-17)31-12-18(28)24-16-5-4-14(21)9-15(16)22/h4-5,8-11H,3,6-7,12H2,1-2H3,(H,24,28)/b17-8+
InChIKey UKYRFJQPDOPXOU-CAOOACKPSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11548
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/1265629; Labnumber: NIV1578; UZI_ID: UZI-011550
Synonyms N-(2,4-dichlorophenyl)-2-({1-(3-methoxypropyl)-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetamide
Temperature 308 °C