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methyl 2-({[[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl](methyl)amino]carbothioyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID KUq2GQW6HGU
InChI InChI=1S/C20H28N4O2S2/c1-6-24-13(3)14(10-21-24)11-23(4)20(27)22-18-17(19(25)26-5)15-8-7-12(2)9-16(15)28-18/h10,12H,6-9,11H2,1-5H3,(H,22,27)
InChIKey NOTPJMLJPMMRMK-UHFFFAOYSA-N
Mol Weight 420.59 g/mol
Molecular Formula C20H28N4O2S2
Exact Mass 420.165369 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LZtIcVVG2GJ
Name methyl 2-({[[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl](methyl)amino]carbothioyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C20H28N4O2S2/c1-6-24-13(3)14(10-21-24)11-23(4)20(27)22-18-17(19(25)26-5)15-8-7-12(2)9-16(15)28-18/h10,12H,6-9,11H2,1-5H3,(H,22,27)
InChIKey NOTPJMLJPMMRMK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8257
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/1268202; Labnumber: COL7263; UZI_ID: UZI-008259
Temperature 318 °C