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methyl 2-[({[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]amino}carbothioyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID FA6LdV5IUC8
InChI InChI=1S/C19H26N4O2S2/c1-5-23-10-13(12(3)22-23)9-20-19(26)21-17-16(18(24)25-4)14-7-6-11(2)8-15(14)27-17/h10-11H,5-9H2,1-4H3,(H2,20,21,26)
InChIKey TWBHJZBUCBYZKJ-UHFFFAOYSA-N
Mol Weight 406.56 g/mol
Molecular Formula C19H26N4O2S2
Exact Mass 406.149718 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HSB9IhakJH1
Name methyl 2-[({[(1-ethyl-3-methyl-1H-pyrazol-4-yl)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/C19H26N4O2S2/c1-5-23-10-13(12(3)22-23)9-20-19(26)21-17-16(18(24)25-4)14-7-6-11(2)8-15(14)27-17/h10-11H,5-9H2,1-4H3,(H2,20,21,26)
InChIKey TWBHJZBUCBYZKJ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8251
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/1268599; Labnumber: COL7255; UZI_ID: UZI-008253
Temperature 318 °C