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ethanediamide, N~1~-[3-(aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]-N~2~-(3-pyridinylmethyl)-
SpectraBase Compound ID F1TFYeCADFg
InChI InChI=1S/C17H18N4O3S/c18-14(22)13-11-5-1-2-6-12(11)25-17(13)21-16(24)15(23)20-9-10-4-3-7-19-8-10/h3-4,7-8H,1-2,5-6,9H2,(H2,18,22)(H,20,23)(H,21,24)
InChIKey POVOQEXSUAVADV-UHFFFAOYSA-N
Mol Weight 358.42 g/mol
Molecular Formula C17H18N4O3S
Exact Mass 358.109962 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JvfVrZnWXw1
Name ethanediamide, N~1~-[3-(aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]-N~2~-(3-pyridinylmethyl)-
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/C17H18N4O3S/c18-14(22)13-11-5-1-2-6-12(11)25-17(13)21-16(24)15(23)20-9-10-4-3-7-19-8-10/h3-4,7-8H,1-2,5-6,9H2,(H2,18,22)(H,20,23)(H,21,24)
InChIKey POVOQEXSUAVADV-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5545
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: NMR/17211191; Labnumber: ARJ-5676