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

SpectraBase Compound ID	HjkoFbHYZ6x
InChI	InChI=1S/C29H30N4O3S2/c1-3-16-36-22-14-10-20(11-15-22)17-30-32-25(34)18-37-29-31-27-26(23-6-4-5-7-24(23)38-27)28(35)33(29)21-12-8-19(2)9-13-21/h8-15,17H,3-7,16,18H2,1-2H3,(H,32,34)/b30-17+
InChIKey	YTVGDQMPQPEOCU-OCSSWDANSA-N Google Search
Mol Weight	546.7 g/mol
Molecular Formula	C29H30N4O3S2
Exact Mass	546.175933 g/mol

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SpectraBase Spectrum ID	D9p7HGqDo1E
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)-(4-propoxyphenyl)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/C29H30N4O3S2/c1-3-16-36-22-14-10-20(11-15-22)17-30-32-25(34)18-37-29-31-27-26(23-6-4-5-7-24(23)38-27)28(35)33(29)21-12-8-19(2)9-13-21/h8-15,17H,3-7,16,18H2,1-2H3,(H,32,34)/b30-17+
InChIKey	YTVGDQMPQPEOCU-OCSSWDANSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_16678
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: D24258; Labnumber: GRES-02155; SBI_ID: SBI-016681
Synonyms	2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N'-[(4-propoxyphenyl)methylidene]acetohydrazide
Temperature	308 °C