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ethyl 2-({[(4-methoxybenzoyl)amino]carbothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID LCvDmg2fzaB
InChI InChI=1S/C20H22N2O4S2/c1-3-26-19(24)16-14-6-4-5-7-15(14)28-18(16)22-20(27)21-17(23)12-8-10-13(25-2)11-9-12/h8-11H,3-7H2,1-2H3,(H2,21,22,23,27)
InChIKey HPKSDAJQAMBEHL-UHFFFAOYSA-N
Mol Weight 418.53 g/mol
Molecular Formula C20H22N2O4S2
Exact Mass 418.1021 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1cGs24wIuYX
Name ethyl 2-({[(4-methoxybenzoyl)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/C20H22N2O4S2/c1-3-26-19(24)16-14-6-4-5-7-15(14)28-18(16)22-20(27)21-17(23)12-8-10-13(25-2)11-9-12/h8-11H,3-7H2,1-2H3,(H2,21,22,23,27)
InChIKey HPKSDAJQAMBEHL-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_2109
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: 801396EX00008826; Labnumber: 801396EX00008826; VK_ID: VK-002110
Temperature 313 °C