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acetamide, N-(2-fluorophenyl)-2-[(3,4,5,6,7,8-hexahydro-7-methyl-4-oxo-3-phenylbenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio]-

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acetamide, N-(2-fluorophenyl)-2-[(3,4,5,6,7,8-hexahydro-7-methyl-4-oxo-3-phenylbenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio]-
SpectraBase Compound ID Fxxzn0yrHPW
InChI InChI=1S/C25H22FN3O2S2/c1-15-11-12-17-20(13-15)33-23-22(17)24(31)29(16-7-3-2-4-8-16)25(28-23)32-14-21(30)27-19-10-6-5-9-18(19)26/h2-10,15H,11-14H2,1H3,(H,27,30)
InChIKey KABYGKHQDXNVRZ-UHFFFAOYSA-N
Mol Weight 479.59 g/mol
Molecular Formula C25H22FN3O2S2
Exact Mass 479.113747 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6OHFafnOQPS
Name acetamide, N-(2-fluorophenyl)-2-[(3,4,5,6,7,8-hexahydro-7-methyl-4-oxo-3-phenylbenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H22FN3O2S2/c1-15-11-12-17-20(13-15)33-23-22(17)24(31)29(16-7-3-2-4-8-16)25(28-23)32-14-21(30)27-19-10-6-5-9-18(19)26/h2-10,15H,11-14H2,1H3,(H,27,30)
InChIKey KABYGKHQDXNVRZ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_443
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/11228073