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5-{[4-(4-chlorobenzyl)-1-piperazinyl]carbonyl}-3-methyl-1-(2-methylphenyl)-1H-thieno[2,3-c]pyrazole
SpectraBase Compound ID 3VdeBg7Xa5i
InChI InChI=1S/C25H25ClN4OS/c1-17-5-3-4-6-22(17)30-25-21(18(2)27-30)15-23(32-25)24(31)29-13-11-28(12-14-29)16-19-7-9-20(26)10-8-19/h3-10,15H,11-14,16H2,1-2H3
InChIKey LNSFNTCXDRBHEM-UHFFFAOYSA-N
Mol Weight 465.02 g/mol
Molecular Formula C25H25ClN4OS
Exact Mass 464.14376 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LPU6CXtgPI1
Name 5-{[4-(4-chlorobenzyl)-1-piperazinyl]carbonyl}-3-methyl-1-(2-methylphenyl)-1H-thieno[2,3-c]pyrazole
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/C25H25ClN4OS/c1-17-5-3-4-6-22(17)30-25-21(18(2)27-30)15-23(32-25)24(31)29-13-11-28(12-14-29)16-19-7-9-20(26)10-8-19/h3-10,15H,11-14,16H2,1-2H3
InChIKey LNSFNTCXDRBHEM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14424
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: D99465; Labnumber: GRESKO-8316; SBI_ID: SBI-014427
Temperature 318 °C