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N'-[(E)-(4-hydroxyphenyl)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 3NLv4BitvtB
InChI InChI=1S/C25H22N4O3S2/c30-18-12-10-16(11-13-18)14-26-28-21(31)15-33-25-27-23-22(19-8-4-5-9-20(19)34-23)24(32)29(25)17-6-2-1-3-7-17/h1-3,6-7,10-14,30H,4-5,8-9,15H2,(H,28,31)/b26-14+
InChIKey NUJRMAGVGQCRFR-VULFUBBASA-N
Mol Weight 490.6 g/mol
Molecular Formula C25H22N4O3S2
Exact Mass 490.113333 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1ce01qbjTBR
Name N'-[(E)-(4-hydroxyphenyl)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/C25H22N4O3S2/c30-18-12-10-16(11-13-18)14-26-28-21(31)15-33-25-27-23-22(19-8-4-5-9-20(19)34-23)24(32)29(25)17-6-2-1-3-7-17/h1-3,6-7,10-14,30H,4-5,8-9,15H2,(H,28,31)/b26-14+
InChIKey NUJRMAGVGQCRFR-VULFUBBASA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16705
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: D24316; Labnumber: GRES-02291; SBI_ID: SBI-016708
Synonyms N'-[(4-hydroxyphenyl)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