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ethanediamide, N~1~-[4-(2-benzothiazolyl)phenyl]-N~2~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-
SpectraBase Compound ID 1OsjXB6R0AE
InChI InChI=1S/C21H19N5O2S/c1-13-15(12-26(2)25-13)11-22-19(27)20(28)23-16-9-7-14(8-10-16)21-24-17-5-3-4-6-18(17)29-21/h3-10,12H,11H2,1-2H3,(H,22,27)(H,23,28)
InChIKey LHFUITCBDKULTN-UHFFFAOYSA-N
Mol Weight 405.48 g/mol
Molecular Formula C21H19N5O2S
Exact Mass 405.125946 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EZIGPHfb5YK
Name ethanediamide, N~1~-[4-(2-benzothiazolyl)phenyl]-N~2~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-
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/C21H19N5O2S/c1-13-15(12-26(2)25-13)11-22-19(27)20(28)23-16-9-7-14(8-10-16)21-24-17-5-3-4-6-18(17)29-21/h3-10,12H,11H2,1-2H3,(H,22,27)(H,23,28)
InChIKey LHFUITCBDKULTN-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_10772
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: F38358; Labnumber: NNA-V-31520