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N'-[(E)-(4-ethoxyphenyl)methylidene]-2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetohydrazide
SpectraBase Compound ID FfaSYShOg7h
InChI InChI=1S/C28H28N4O3S2/c1-3-35-21-14-10-19(11-15-21)16-29-31-24(33)17-36-28-30-26-25(22-6-4-5-7-23(22)37-26)27(34)32(28)20-12-8-18(2)9-13-20/h8-16H,3-7,17H2,1-2H3,(H,31,33)/b29-16+
InChIKey LWVULMHVBMIJPB-MUFRIFMGSA-N
Mol Weight 532.68 g/mol
Molecular Formula C28H28N4O3S2
Exact Mass 532.160283 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CeTaEpEFdnW
Name N'-[(E)-(4-ethoxyphenyl)methylidene]-2-{[3-(4-methylphenyl)-4-oxo-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/C28H28N4O3S2/c1-3-35-21-14-10-19(11-15-21)16-29-31-24(33)17-36-28-30-26-25(22-6-4-5-7-23(22)37-26)27(34)32(28)20-12-8-18(2)9-13-20/h8-16H,3-7,17H2,1-2H3,(H,31,33)/b29-16+
InChIKey LWVULMHVBMIJPB-MUFRIFMGSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_5820
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: D24188; Labnumber: GRES-02085; SBI_ID: SBI-005823
Synonyms N'-[(4-ethoxyphenyl)methylidene]-2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetohydrazide
Temperature 306 °C