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

SpectraBase Compound ID	2h2dp0B2KTT
InChI	InChI=1S/C25H25N5O2S2/c1-16-9-11-17(12-10-16)30-24(32)22-19-7-3-4-8-20(19)34-23(22)27-25(30)33-15-21(31)28-26-14-18-6-5-13-29(18)2/h5-6,9-14H,3-4,7-8,15H2,1-2H3,(H,28,31)/b26-14+
InChIKey	YTNKMPRHSZNCBY-VULFUBBASA-N Google Search
Mol Weight	491.63 g/mol
Molecular Formula	C25H25N5O2S2
Exact Mass	491.144967 g/mol

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SpectraBase Spectrum ID	3bNmHeGeF7
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)-(1-methyl-1H-pyrrol-2-yl)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/C25H25N5O2S2/c1-16-9-11-17(12-10-16)30-24(32)22-19-7-3-4-8-20(19)34-23(22)27-25(30)33-15-21(31)28-26-14-18-6-5-13-29(18)2/h5-6,9-14H,3-4,7-8,15H2,1-2H3,(H,28,31)/b26-14+
InChIKey	YTNKMPRHSZNCBY-VULFUBBASA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_16666
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: D24226; Labnumber: GRES-02123; SBI_ID: SBI-016669
Synonyms	2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N'-[(1-methyl-1H-pyrrol-2-yl)methylidene]acetohydrazide
Temperature	308 °C