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N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-2-[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetohydrazide
SpectraBase Compound ID 92s1Glnj9Fw
InChI InChI=1S/C26H24N4O4S2/c1-34-20-13-16(11-12-19(20)31)14-27-29-22(32)15-35-26-28-24-23(18-9-5-6-10-21(18)36-24)25(33)30(26)17-7-3-2-4-8-17/h2-4,7-8,11-14,31H,5-6,9-10,15H2,1H3,(H,29,32)/b27-14+
InChIKey QTBCWUIHPQRBDE-MZJWZYIUSA-N
Mol Weight 520.62 g/mol
Molecular Formula C26H24N4O4S2
Exact Mass 520.123898 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AfBMfCq6WF1
Name N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-2-[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetohydrazide
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/C26H24N4O4S2/c1-34-20-13-16(11-12-19(20)31)14-27-29-22(32)15-35-26-28-24-23(18-9-5-6-10-21(18)36-24)25(33)30(26)17-7-3-2-4-8-17/h2-4,7-8,11-14,31H,5-6,9-10,15H2,1H3,(H,29,32)/b27-14+
InChIKey QTBCWUIHPQRBDE-MZJWZYIUSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16702
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: D24311; Labnumber: GRES-02285; SBI_ID: SBI-016705
Synonyms N'-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetohydrazide
Temperature 318 °C