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N-benzyl-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-benzyl-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 BeM9n3eoJur
InChI InChI=1S/C22H27N5O2S/c1-15(2)12-27-21(29)19(10-18-13-26(4)25-16(18)3)24-22(27)30-14-20(28)23-11-17-8-6-5-7-9-17/h5-10,13,15H,11-12,14H2,1-4H3,(H,23,28)/b19-10+
InChIKey ZAKOERXUZADZJT-VXLYETTFSA-N
Mol Weight 425.55 g/mol
Molecular Formula C22H27N5O2S
Exact Mass 425.188546 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3u3OZFb48L7
Name N-benzyl-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/C22H27N5O2S/c1-15(2)12-27-21(29)19(10-18-13-26(4)25-16(18)3)24-22(27)30-14-20(28)23-11-17-8-6-5-7-9-17/h5-10,13,15H,11-12,14H2,1-4H3,(H,23,28)/b19-10+
InChIKey ZAKOERXUZADZJT-VXLYETTFSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11496
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/1267833; Labnumber: NIV1497; UZI_ID: UZI-011498
Synonyms N-benzyl-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