N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)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	476i4freVU6
InChI	InChI=1S/C27H26N4O5S2/c1-35-19-12-16(13-20(36-2)24(19)33)14-28-30-22(32)15-37-27-29-25-23(18-10-6-7-11-21(18)38-25)26(34)31(27)17-8-4-3-5-9-17/h3-5,8-9,12-14,33H,6-7,10-11,15H2,1-2H3,(H,30,32)/b28-14+
InChIKey	JMKMZDWEWALELK-CCVNUDIWSA-N Google Search
Mol Weight	550.65 g/mol
Molecular Formula	C27H26N4O5S2
Exact Mass	550.134462 g/mol

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SpectraBase Spectrum ID	5s1eh11d8Kd
Name	N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)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/C27H26N4O5S2/c1-35-19-12-16(13-20(36-2)24(19)33)14-28-30-22(32)15-37-27-29-25-23(18-10-6-7-11-21(18)38-25)26(34)31(27)17-8-4-3-5-9-17/h3-5,8-9,12-14,33H,6-7,10-11,15H2,1-2H3,(H,30,32)/b28-14+
InChIKey	JMKMZDWEWALELK-CCVNUDIWSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_16733
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: D24379; Labnumber: GRES-02357; SBI_ID: SBI-016736
Synonyms	N'-[(4-hydroxy-3,5-dimethoxyphenyl)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