N'-[(E)-1-(3-bromophenyl)ethylidene]-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	JnXfEFVtzLL
InChI	InChI=1S/C27H25BrN4O2S2/c1-16-10-12-20(13-11-16)32-26(34)24-21-8-3-4-9-22(21)36-25(24)29-27(32)35-15-23(33)31-30-17(2)18-6-5-7-19(28)14-18/h5-7,10-14H,3-4,8-9,15H2,1-2H3,(H,31,33)/b30-17+
InChIKey	JZPYODJOBLGGRB-OCSSWDANSA-N Google Search
Mol Weight	581.55 g/mol
Molecular Formula	C27H25BrN4O2S2
Exact Mass	580.060231 g/mol

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SpectraBase Spectrum ID	HpcFC311Nkj
Name	N'-[(E)-1-(3-bromophenyl)ethylidene]-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/C27H25BrN4O2S2/c1-16-10-12-20(13-11-16)32-26(34)24-21-8-3-4-9-22(21)36-25(24)29-27(32)35-15-23(33)31-30-17(2)18-6-5-7-19(28)14-18/h5-7,10-14H,3-4,8-9,15H2,1-2H3,(H,31,33)/b30-17+
InChIKey	JZPYODJOBLGGRB-OCSSWDANSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_16673
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: D24247; Labnumber: GRES-02144; SBI_ID: SBI-016676
Synonyms	N'-[1-(3-bromophenyl)ethylidene]-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