2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N'-[(E)-(2-nitrophenyl)methylidene]acetohydrazide

SpectraBase Compound ID	BdItoT34Cpv
InChI	InChI=1S/C26H23N5O4S2/c1-16-10-12-18(13-11-16)30-25(33)23-19-7-3-5-9-21(19)37-24(23)28-26(30)36-15-22(32)29-27-14-17-6-2-4-8-20(17)31(34)35/h2,4,6,8,10-14H,3,5,7,9,15H2,1H3,(H,29,32)/b27-14+
InChIKey	MCWXJHBIBWXRNW-MZJWZYIUSA-N Google Search
Mol Weight	533.62 g/mol
Molecular Formula	C26H23N5O4S2
Exact Mass	533.119147 g/mol

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SpectraBase Spectrum ID	3B93AeyzHIZ
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)-(2-nitrophenyl)methylidene]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/C26H23N5O4S2/c1-16-10-12-18(13-11-16)30-25(33)23-19-7-3-5-9-21(19)37-24(23)28-26(30)36-15-22(32)29-27-14-17-6-2-4-8-20(17)31(34)35/h2,4,6,8,10-14H,3,5,7,9,15H2,1H3,(H,29,32)/b27-14+
InChIKey	MCWXJHBIBWXRNW-MZJWZYIUSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_5813
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: D24175; Labnumber: GRES-02072; SBI_ID: SBI-005816
Synonyms	2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N'-[(2-nitrophenyl)methylidene]acetohydrazide
Temperature	306 °C