2-{[(4E)-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-1-(3-methoxypropyl)-5-oxo-4,5-dihydro-1H-imidazol-2-yl]sulfanyl}-N-(4-nitrophenyl)acetamide

SpectraBase Compound ID	3Xte1fbu5nj
InChI	InChI=1S/C21H24N6O5S/c1-14-15(12-25(2)24-14)11-18-20(29)26(9-4-10-32-3)21(23-18)33-13-19(28)22-16-5-7-17(8-6-16)27(30)31/h5-8,11-12H,4,9-10,13H2,1-3H3,(H,22,28)/b18-11+
InChIKey	VXESYQWIDVSUPU-WOJGMQOQSA-N Google Search
Mol Weight	472.52 g/mol
Molecular Formula	C21H24N6O5S
Exact Mass	472.152889 g/mol

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SpectraBase Spectrum ID	IQ6bbhNRWrV
Name	2-{[(4E)-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-1-(3-methoxypropyl)-5-oxo-4,5-dihydro-1H-imidazol-2-yl]sulfanyl}-N-(4-nitrophenyl)acetamide
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/C21H24N6O5S/c1-14-15(12-25(2)24-14)11-18-20(29)26(9-4-10-32-3)21(23-18)33-13-19(28)22-16-5-7-17(8-6-16)27(30)31/h5-8,11-12H,4,9-10,13H2,1-3H3,(H,22,28)/b18-11+
InChIKey	VXESYQWIDVSUPU-WOJGMQOQSA-N
NMR Offset	17.1563
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_11563
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: UZI/1267846; Labnumber: NIV1593; UZI_ID: UZI-011565
Synonyms	2-{[4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylene]-1-(3-methoxypropyl)-5-oxo-4,5-dihydro-1H-imidazol-2-yl]sulfanyl}-N-(4-nitrophenyl)acetamide
Temperature	308 °C