(2E)-N-(5-{[2-(4-ethoxyanilino)-1-methyl-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenyl-2-propenamide

SpectraBase Compound ID	7Nfi0GDzIWD
InChI	InChI=1S/C22H22N4O3S2/c1-3-29-18-12-10-17(11-13-18)23-20(28)15(2)30-22-26-25-21(31-22)24-19(27)14-9-16-7-5-4-6-8-16/h4-15H,3H2,1-2H3,(H,23,28)(H,24,25,27)/b14-9+
InChIKey	XURIYAHFDFOXOJ-NTEUORMPSA-N Google Search
Mol Weight	454.56 g/mol
Molecular Formula	C22H22N4O3S2
Exact Mass	454.113333 g/mol

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SpectraBase Spectrum ID	JyRaEhFbVVK
Name	(2E)-N-(5-{[2-(4-ethoxyanilino)-1-methyl-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenyl-2-propenamide
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/C22H22N4O3S2/c1-3-29-18-12-10-17(11-13-18)23-20(28)15(2)30-22-26-25-21(31-22)24-19(27)14-9-16-7-5-4-6-8-16/h4-15H,3H2,1-2H3,(H,23,28)(H,24,25,27)/b14-9+
InChIKey	XURIYAHFDFOXOJ-NTEUORMPSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_3030
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: D06435; Labnumber: SPKOL-4337; SBI_ID: SBI-003032
Synonyms	N-(5-{[2-(4-ethoxyanilino)-1-methyl-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenyl-2-propenamide
Temperature	306 °C