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2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N'-[(E,2E)-3-phenyl-2-propenylidene]acetohydrazide
SpectraBase Compound ID 9xgn2qQ8Thp
InChI InChI=1S/C28H26N4O2S2/c1-19-13-15-21(16-14-19)32-27(34)25-22-11-5-6-12-23(22)36-26(25)30-28(32)35-18-24(33)31-29-17-7-10-20-8-3-2-4-9-20/h2-4,7-10,13-17H,5-6,11-12,18H2,1H3,(H,31,33)/b10-7+,29-17+
InChIKey RKERKRZNNNCYCL-FISATAHSSA-N
Mol Weight 514.66 g/mol
Molecular Formula C28H26N4O2S2
Exact Mass 514.149718 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FY1hieIMcdw
Name 2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N'-[(E,2E)-3-phenyl-2-propenylidene]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/C28H26N4O2S2/c1-19-13-15-21(16-14-19)32-27(34)25-22-11-5-6-12-23(22)36-26(25)30-28(32)35-18-24(33)31-29-17-7-10-20-8-3-2-4-9-20/h2-4,7-10,13-17H,5-6,11-12,18H2,1H3,(H,31,33)/b10-7+,29-17+
InChIKey RKERKRZNNNCYCL-FISATAHSSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16663
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: D24221; Labnumber: GRES-02118; SBI_ID: SBI-016666
Synonyms 2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N'-[3-phenyl-2-propenylidene]acetohydrazide
Temperature 308 °C