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

View entire compound with spectra: 1 NMR

N-(2,4-dichlorophenyl)-2-{[(4E)-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-1-(3-methoxypropyl)-5-oxo-4,5-dihydro-1H-imidazol-2-yl]sulfanyl}acetamide
SpectraBase Compound ID IcoeEKVq1p0
InChI InChI=1S/C21H23Cl2N5O3S/c1-13-14(11-27(2)26-13)9-18-20(30)28(7-4-8-31-3)21(25-18)32-12-19(29)24-17-6-5-15(22)10-16(17)23/h5-6,9-11H,4,7-8,12H2,1-3H3,(H,24,29)/b18-9+
InChIKey HRPIFDCTUHMZTA-GIJQJNRQSA-N
Mol Weight 496.41 g/mol
Molecular Formula C21H23Cl2N5O3S
Exact Mass 495.089866 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Fv7uGeraSU
Name N-(2,4-dichlorophenyl)-2-{[(4E)-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-1-(3-methoxypropyl)-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/C21H23Cl2N5O3S/c1-13-14(11-27(2)26-13)9-18-20(30)28(7-4-8-31-3)21(25-18)32-12-19(29)24-17-6-5-15(22)10-16(17)23/h5-6,9-11H,4,7-8,12H2,1-3H3,(H,24,29)/b18-9+
InChIKey HRPIFDCTUHMZTA-GIJQJNRQSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11568
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/1266306; Labnumber: NIV1598; UZI_ID: UZI-011570
Synonyms N-(2,4-dichlorophenyl)-2-{[4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-1-(3-methoxypropyl)-5-oxo-4,5-dihydro-1H-imidazol-2-yl]sulfanyl}acetamide
Temperature 308 °C