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N-(4-oxo-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)nicotinamide
SpectraBase Compound ID GWVVkuncgC5
InChI InChI=1S/C16H14N4O2S2/c21-13(9-4-3-7-17-8-9)19-20-15(22)12-10-5-1-2-6-11(10)24-14(12)18-16(20)23/h3-4,7-8H,1-2,5-6H2,(H,18,23)(H,19,21)
InChIKey CSYJTWLWFJVGHB-UHFFFAOYSA-N
Mol Weight 358.43 g/mol
Molecular Formula C16H14N4O2S2
Exact Mass 358.055818 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EESnzJDoE82
Name N-(4-oxo-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)nicotinamide
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/C16H14N4O2S2/c21-13(9-4-3-7-17-8-9)19-20-15(22)12-10-5-1-2-6-11(10)24-14(12)18-16(20)23/h3-4,7-8H,1-2,5-6H2,(H,18,23)(H,19,21)
InChIKey CSYJTWLWFJVGHB-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7809
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/1269889; Labnumber: COL6173; UZI_ID: UZI-007811
Temperature 318 °C