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methyl 2-({[(2-methoxybenzyl)amino]carbothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 5n5JUL3S7dv
InChI InChI=1S/C19H22N2O3S2/c1-23-14-9-5-3-7-12(14)11-20-19(25)21-17-16(18(22)24-2)13-8-4-6-10-15(13)26-17/h3,5,7,9H,4,6,8,10-11H2,1-2H3,(H2,20,21,25)
InChIKey PVACBRXSUTUUIF-UHFFFAOYSA-N
Mol Weight 390.52 g/mol
Molecular Formula C19H22N2O3S2
Exact Mass 390.107185 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LNnmvZKfv44
Name methyl 2-({[(2-methoxybenzyl)amino]carbothioyl}amino)-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/C19H22N2O3S2/c1-23-14-9-5-3-7-12(14)11-20-19(25)21-17-16(18(22)24-2)13-8-4-6-10-15(13)26-17/h3,5,7,9H,4,6,8,10-11H2,1-2H3,(H2,20,21,25)
InChIKey PVACBRXSUTUUIF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7797
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/1269036; Labnumber: COL6152; UZI_ID: UZI-007799
Temperature 318 °C