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N-(1-benzyl-1H-pyrazol-4-yl)-2-[(1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-4-yl)carbonyl]hydrazinecarbothioamide
SpectraBase Compound ID 70qFVnYaa6E
InChI InChI=1S/C21H22N8OS/c1-13-9-17(18-14(2)27-28(3)19(18)23-13)20(30)25-26-21(31)24-16-10-22-29(12-16)11-15-7-5-4-6-8-15/h4-10,12H,11H2,1-3H3,(H,25,30)(H2,24,26,31)
InChIKey WIIPODFALJUFTH-UHFFFAOYSA-N
Mol Weight 434.52 g/mol
Molecular Formula C21H22N8OS
Exact Mass 434.163729 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9KJfm5gSftH
Name N-(1-benzyl-1H-pyrazol-4-yl)-2-[(1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-4-yl)carbonyl]hydrazinecarbothioamide
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/C21H22N8OS/c1-13-9-17(18-14(2)27-28(3)19(18)23-13)20(30)25-26-21(31)24-16-10-22-29(12-16)11-15-7-5-4-6-8-15/h4-10,12H,11H2,1-3H3,(H,25,30)(H2,24,26,31)
InChIKey WIIPODFALJUFTH-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31466
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: 1840723; SBI_ID: SBI-031470
Temperature 306 °C