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N-(3-chlorophenyl)-2-[3-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propyl]-1-(4-methoxyphenyl)-5-oxo-2-thioxo-4-imidazolidinyl]acetamide
SpectraBase Compound ID DEJMehuNtZx
InChI InChI=1S/C26H27ClN6O5S/c1-16-24(33(36)37)17(2)31(29-16)13-5-12-30-22(15-23(34)28-19-7-4-6-18(27)14-19)25(35)32(26(30)39)20-8-10-21(38-3)11-9-20/h4,6-11,14,22H,5,12-13,15H2,1-3H3,(H,28,34)
InChIKey GCXMOYZWRVMPIM-UHFFFAOYSA-N
Mol Weight 571.05 g/mol
Molecular Formula C26H27ClN6O5S
Exact Mass 570.145217 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KnjYYa1shBI
Name N-(3-chlorophenyl)-2-[3-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propyl]-1-(4-methoxyphenyl)-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/C26H27ClN6O5S/c1-16-24(33(36)37)17(2)31(29-16)13-5-12-30-22(15-23(34)28-19-7-4-6-18(27)14-19)25(35)32(26(30)39)20-8-10-21(38-3)11-9-20/h4,6-11,14,22H,5,12-13,15H2,1-3H3,(H,28,34)
InChIKey GCXMOYZWRVMPIM-UHFFFAOYSA-N
NMR Offset 15.3548
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_UZI_26187_16762
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: UZI/1262624; Labnumber: POL0023; UZI_ID: UZI-016766
Temperature 318 °C