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N-(6-benzyl-4-oxo-2-sulfanylthieno[2,3-d]pyrimidin-3(4H)-yl)-5-bromo-2-furamide
SpectraBase Compound ID kSgi7vkfWd
InChI InChI=1S/C18H12BrN3O3S2/c19-14-7-6-13(25-14)15(23)21-22-17(24)12-9-11(27-16(12)20-18(22)26)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,20,26)(H,21,23)
InChIKey PUSGRHXNIUPBRP-UHFFFAOYSA-N
Mol Weight 462.34 g/mol
Molecular Formula C18H12BrN3O3S2
Exact Mass 460.950347 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 88WPIQtsYjL
Name N-(6-benzyl-4-oxo-2-sulfanylthieno[2,3-d]pyrimidin-3(4H)-yl)-5-bromo-2-furamide
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/C18H12BrN3O3S2/c19-14-7-6-13(25-14)15(23)21-22-17(24)12-9-11(27-16(12)20-18(22)26)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,20,26)(H,21,23)
InChIKey PUSGRHXNIUPBRP-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7940
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/1269073; Labnumber: COL6461; UZI_ID: UZI-007942
Temperature 318 °C