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2-{[phenyl(phenylsulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID 4N9Csj3ru8V
InChI InChI=1S/C23H22N2O2S2/c24-21(26)19-17-13-7-8-14-18(17)29-23(19)25-22(27)20(15-9-3-1-4-10-15)28-16-11-5-2-6-12-16/h1-6,9-12,20H,7-8,13-14H2,(H2,24,26)(H,25,27)
InChIKey VOBDBIUXXNHYEY-UHFFFAOYSA-N
Mol Weight 422.56 g/mol
Molecular Formula C23H22N2O2S2
Exact Mass 422.11227 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IrQ94hJ6umb
Name 2-{[phenyl(phenylsulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
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/C23H22N2O2S2/c24-21(26)19-17-13-7-8-14-18(17)29-23(19)25-22(27)20(15-9-3-1-4-10-15)28-16-11-5-2-6-12-16/h1-6,9-12,20H,7-8,13-14H2,(H2,24,26)(H,25,27)
InChIKey VOBDBIUXXNHYEY-UHFFFAOYSA-N
NMR Offset 14.4773
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_16631
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/8150752; UBI_ID: UBI-016634
Temperature 313 °C