N'-[(E,2Z)-2-chloro-3-phenyl-2-propenylidene]-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	77UUe6JcU28
InChI	InChI=1S/C28H25ClN4O2S2/c1-18-11-13-21(14-12-18)33-27(35)25-22-9-5-6-10-23(22)37-26(25)31-28(33)36-17-24(34)32-30-16-20(29)15-19-7-3-2-4-8-19/h2-4,7-8,11-16H,5-6,9-10,17H2,1H3,(H,32,34)/b20-15-,30-16+
InChIKey	YJASPBDVFBPQJW-BMLQAHPBSA-N Google Search
Mol Weight	549.11 g/mol
Molecular Formula	C28H25ClN4O2S2
Exact Mass	548.110746 g/mol

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SpectraBase Spectrum ID	7qTaXrs3bTW
Name	N'-[(E,2Z)-2-chloro-3-phenyl-2-propenylidene]-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/C28H25ClN4O2S2/c1-18-11-13-21(14-12-18)33-27(35)25-22-9-5-6-10-23(22)37-26(25)31-28(33)36-17-24(34)32-30-16-20(29)15-19-7-3-2-4-8-19/h2-4,7-8,11-16H,5-6,9-10,17H2,1H3,(H,32,34)/b20-15-,30-16+
InChIKey	YJASPBDVFBPQJW-BMLQAHPBSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_16647
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: D24201; Labnumber: GRES-02098; SBI_ID: SBI-016650
Synonyms	N'-[2-chloro-3-phenyl-2-propenylidene]-2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetohydrazide
Temperature	308 °C