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

SpectraBase Compound ID	BN3hcTFnF01
InChI	InChI=1S/C19H15N5O4S2/c25-16(11-10-13-6-2-1-3-7-13)21-18-22-23-19(30-18)29-12-17(26)20-14-8-4-5-9-15(14)24(27)28/h1-11H,12H2,(H,20,26)(H,21,22,25)/b11-10+
InChIKey	VWULRDAQXITMDM-ZHACJKMWSA-N Google Search
Mol Weight	441.48 g/mol
Molecular Formula	C19H15N5O4S2
Exact Mass	441.056546 g/mol

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SpectraBase Spectrum ID	xSn8c5rmT9
Name	(2E)-N-(5-{[2-(2-nitroanilino)-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/C19H15N5O4S2/c25-16(11-10-13-6-2-1-3-7-13)21-18-22-23-19(30-18)29-12-17(26)20-14-8-4-5-9-15(14)24(27)28/h1-11H,12H2,(H,20,26)(H,21,22,25)/b11-10+
InChIKey	VWULRDAQXITMDM-ZHACJKMWSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_6490
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: D14952; Labnumber: SPKOL-4269; SBI_ID: SBI-006493
Synonyms	N-(5-{[2-(2-nitroanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenyl-2-propenamide
Temperature	306 °C