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

SpectraBase Compound ID	BCPsWNmuCcf
InChI	InChI=1S/C21H19ClN4O3S2/c22-16-7-9-17(10-8-16)29-13-12-23-19(28)14-30-21-26-25-20(31-21)24-18(27)11-6-15-4-2-1-3-5-15/h1-11H,12-14H2,(H,23,28)(H,24,25,27)/b11-6+
InChIKey	UQBYURBRMLURCE-IZZDOVSWSA-N Google Search
Mol Weight	474.98 g/mol
Molecular Formula	C21H19ClN4O3S2
Exact Mass	474.058711 g/mol

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SpectraBase Spectrum ID	5GG27IA0uCS
Name	(2E)-N-{5-[(2-{[2-(4-chlorophenoxy)ethyl]amino}-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/C21H19ClN4O3S2/c22-16-7-9-17(10-8-16)29-13-12-23-19(28)14-30-21-26-25-20(31-21)24-18(27)11-6-15-4-2-1-3-5-15/h1-11H,12-14H2,(H,23,28)(H,24,25,27)/b11-6+
InChIKey	UQBYURBRMLURCE-IZZDOVSWSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_12607
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: D76969; Labnumber: SPKOL-4354; SBI_ID: SBI-012610
Synonyms	N-{5-[(2-{[2-(4-chlorophenoxy)ethyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenyl-2-propenamide
Temperature	318 °C