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2-({(4E)-1-isobutyl-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)-N-(1-naphthyl)acetamide
SpectraBase Compound ID BJadXvOciGN
InChI InChI=1S/C24H25N5O2S/c1-16(2)13-29-23(31)21(11-17-12-25-28(3)14-17)27-24(29)32-15-22(30)26-20-10-6-8-18-7-4-5-9-19(18)20/h4-12,14,16H,13,15H2,1-3H3,(H,26,30)/b21-11+
InChIKey KNMCQUOVDPTWNF-SRZZPIQSSA-N
Mol Weight 447.56 g/mol
Molecular Formula C24H25N5O2S
Exact Mass 447.172896 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7yXIkp9tnnN
Name 2-({(4E)-1-isobutyl-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)-N-(1-naphthyl)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/C24H25N5O2S/c1-16(2)13-29-23(31)21(11-17-12-25-28(3)14-17)27-24(29)32-15-22(30)26-20-10-6-8-18-7-4-5-9-19(18)20/h4-12,14,16H,13,15H2,1-3H3,(H,26,30)/b21-11+
InChIKey KNMCQUOVDPTWNF-SRZZPIQSSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11539
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/1266216; Labnumber: NIV1569; UZI_ID: UZI-011541
Synonyms 2-({1-isobutyl-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)-N-(1-naphthyl)acetamide
Temperature 308 °C