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methyl 2-{[(2-isonicotinoylhydrazino)carbothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 3HoqAlAJzev
InChI InChI=1S/C17H18N4O3S2/c1-24-16(23)13-11-4-2-3-5-12(11)26-15(13)19-17(25)21-20-14(22)10-6-8-18-9-7-10/h6-9H,2-5H2,1H3,(H,20,22)(H2,19,21,25)
InChIKey XNOIRLCESUSKLK-UHFFFAOYSA-N
Mol Weight 390.48 g/mol
Molecular Formula C17H18N4O3S2
Exact Mass 390.082033 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID j3gepVS2nt
Name methyl 2-{[(2-isonicotinoylhydrazino)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/C17H18N4O3S2/c1-24-16(23)13-11-4-2-3-5-12(11)26-15(13)19-17(25)21-20-14(22)10-6-8-18-9-7-10/h6-9H,2-5H2,1H3,(H,20,22)(H2,19,21,25)
InChIKey XNOIRLCESUSKLK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7761
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/1268459; Labnumber: COL6073; UZI_ID: UZI-007763
Temperature 318 °C