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

SpectraBase Compound ID	Ab8Lo1QBDFO
InChI	InChI=1S/C20H22N6O5S/c1-24-12-14(11-21-24)10-17-19(28)25(8-3-9-31-2)20(23-17)32-13-18(27)22-15-4-6-16(7-5-15)26(29)30/h4-7,10-12H,3,8-9,13H2,1-2H3,(H,22,27)/b17-10+
InChIKey	FIRQITZADQOLLG-LICLKQGHSA-N Google Search
Mol Weight	458.49 g/mol
Molecular Formula	C20H22N6O5S
Exact Mass	458.137239 g/mol

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SpectraBase Spectrum ID	1f5tuS6nt6G
Name	2-({(4E)-1-(3-methoxypropyl)-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-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/C20H22N6O5S/c1-24-12-14(11-21-24)10-17-19(28)25(8-3-9-31-2)20(23-17)32-13-18(27)22-15-4-6-16(7-5-15)26(29)30/h4-7,10-12H,3,8-9,13H2,1-2H3,(H,22,27)/b17-10+
InChIKey	FIRQITZADQOLLG-LICLKQGHSA-N
NMR Offset	17.1563
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_11543
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/1268030; Labnumber: NIV1573; UZI_ID: UZI-011545
Synonyms	2-({1-(3-methoxypropyl)-4-[(1-methyl-1H-pyrazol-4-yl)methylene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)-N-(4-nitrophenyl)acetamide
Temperature	308 °C