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ethyl 5-benzyl-2-({[[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl](methyl)amino]carbothioyl}amino)-3-thiophenecarboxylate
SpectraBase Compound ID IaBXzeMrIUp
InChI InChI=1S/C23H28N4O2S2/c1-5-27-16(3)18(14-24-27)15-26(4)23(30)25-21-20(22(28)29-6-2)13-19(31-21)12-17-10-8-7-9-11-17/h7-11,13-14H,5-6,12,15H2,1-4H3,(H,25,30)
InChIKey YZBBSPICXHJDEH-UHFFFAOYSA-N
Mol Weight 456.62 g/mol
Molecular Formula C23H28N4O2S2
Exact Mass 456.165369 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4kgs8DfuLJ7
Name ethyl 5-benzyl-2-({[[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl](methyl)amino]carbothioyl}amino)-3-thiophenecarboxylate
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/C23H28N4O2S2/c1-5-27-16(3)18(14-24-27)15-26(4)23(30)25-21-20(22(28)29-6-2)13-19(31-21)12-17-10-8-7-9-11-17/h7-11,13-14H,5-6,12,15H2,1-4H3,(H,25,30)
InChIKey YZBBSPICXHJDEH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7933
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: UZI/1269499; Labnumber: COL6452; UZI_ID: UZI-007935
Temperature 318 °C