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N-(4-chlorophenyl)-2-{1-(4-chlorophenyl)-3-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-oxo-2-thioxo-4-imidazolidinyl}acetamide
SpectraBase Compound ID 8lxTUH3RuEV
InChI InChI=1S/C23H21Cl2N5O2S/c1-14-15(12-26-28(14)2)13-29-20(11-21(31)27-18-7-3-16(24)4-8-18)22(32)30(23(29)33)19-9-5-17(25)6-10-19/h3-10,12,20H,11,13H2,1-2H3,(H,27,31)
InChIKey DFMCJLUIJUBEDA-UHFFFAOYSA-N
Mol Weight 502.42 g/mol
Molecular Formula C23H21Cl2N5O2S
Exact Mass 501.079302 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3e91MAeAoHU
Name N-(4-chlorophenyl)-2-{1-(4-chlorophenyl)-3-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-oxo-2-thioxo-4-imidazolidinyl}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/C23H21Cl2N5O2S/c1-14-15(12-26-28(14)2)13-29-20(11-21(31)27-18-7-3-16(24)4-8-18)22(32)30(23(29)33)19-9-5-17(25)6-10-19/h3-10,12,20H,11,13H2,1-2H3,(H,27,31)
InChIKey DFMCJLUIJUBEDA-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_14826
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/1020252; UBI_ID: UBI-014829
Temperature 308 °C