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N'-[(E)-(2,4-dichlorophenyl)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 I3KR3u7CRV6
InChI InChI=1S/C25H20Cl2N4O2S2/c26-16-11-10-15(19(27)12-16)13-28-30-21(32)14-34-25-29-23-22(18-8-4-5-9-20(18)35-23)24(33)31(25)17-6-2-1-3-7-17/h1-3,6-7,10-13H,4-5,8-9,14H2,(H,30,32)/b28-13+
InChIKey HIRAQXSREWLBQV-XODNFHPESA-N
Mol Weight 543.49 g/mol
Molecular Formula C25H20Cl2N4O2S2
Exact Mass 542.040474 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GW3rJvh62AI
Name N'-[(E)-(2,4-dichlorophenyl)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/C25H20Cl2N4O2S2/c26-16-11-10-15(19(27)12-16)13-28-30-21(32)14-34-25-29-23-22(18-8-4-5-9-20(18)35-23)24(33)31(25)17-6-2-1-3-7-17/h1-3,6-7,10-13H,4-5,8-9,14H2,(H,30,32)/b28-13+
InChIKey HIRAQXSREWLBQV-XODNFHPESA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16706
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: D24317; Labnumber: GRES-02292; SBI_ID: SBI-016709
Synonyms N'-[(2,4-dichlorophenyl)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