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2-thiophenecarboxylic acid, 3-[[[4-(2-pyridinyl)-1-piperazinyl]carbonothioyl]amino]-, methyl ester
SpectraBase Compound ID Ivw0cyGli4o
InChI InChI=1S/C16H18N4O2S2/c1-22-15(21)14-12(5-11-24-14)18-16(23)20-9-7-19(8-10-20)13-4-2-3-6-17-13/h2-6,11H,7-10H2,1H3,(H,18,23)
InChIKey CHDVXEHZONRPSO-UHFFFAOYSA-N
Mol Weight 362.47 g/mol
Molecular Formula C16H18N4O2S2
Exact Mass 362.087118 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BKqx5k8n023
Name 2-thiophenecarboxylic acid, 3-[[[4-(2-pyridinyl)-1-piperazinyl]carbonothioyl]amino]-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.087118182 u
Formula C16H18N4O2S2
InChI InChI=1S/C16H18N4O2S2/c1-22-15(21)14-12(5-11-24-14)18-16(23)20-9-7-19(8-10-20)13-4-2-3-6-17-13/h2-6,11H,7-10H2,1H3,(H,18,23)
InChIKey CHDVXEHZONRPSO-UHFFFAOYSA-N
Molecular Weight 362.466 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1047
Solvent DMSO-d6
Source Vendor ID: NMR/13239632