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N'-{(E)-[4-(methylsulfanyl)phenyl]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 BtflDbDS3Z
InChI InChI=1S/C26H24N4O2S3/c1-33-19-13-11-17(12-14-19)15-27-29-22(31)16-34-26-28-24-23(20-9-5-6-10-21(20)35-24)25(32)30(26)18-7-3-2-4-8-18/h2-4,7-8,11-15H,5-6,9-10,16H2,1H3,(H,29,31)/b27-15+
InChIKey KDMIJDLCIWFQKY-JFLMPSFJSA-N
Mol Weight 520.68 g/mol
Molecular Formula C26H24N4O2S3
Exact Mass 520.10614 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 16wdN3x38Cd
Name N'-{(E)-[4-(methylsulfanyl)phenyl]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/C26H24N4O2S3/c1-33-19-13-11-17(12-14-19)15-27-29-22(31)16-34-26-28-24-23(20-9-5-6-10-21(20)35-24)25(32)30(26)18-7-3-2-4-8-18/h2-4,7-8,11-15H,5-6,9-10,16H2,1H3,(H,29,31)/b27-15+
InChIKey KDMIJDLCIWFQKY-JFLMPSFJSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16693
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: D24295; Labnumber: GRES-02269; SBI_ID: SBI-016696
Synonyms N'-{[4-(methylsulfanyl)phenyl]methylidene}-2-[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetohydrazide
Temperature 308 °C