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2-[2-(3,4-Dimethoxyphenyl)-1-(4-oxo-4,5-dihydrothiazol-2-yl)vinyl]-5-cinnamoylamino-1,3,4-thiadiazole
SpectraBase Compound ID 3jQ5Npwx5N9
InChI InChI=1S/C24H20N4O4S2/c1-31-18-10-8-16(13-19(18)32-2)12-17(22-25-21(30)14-33-22)23-27-28-24(34-23)26-20(29)11-9-15-6-4-3-5-7-15/h3-13H,14H2,1-2H3,(H,26,28,29)
InChIKey NRHTZDUSHWVAPN-UHFFFAOYSA-N
Mol Weight 492.57 g/mol
Molecular Formula C24H20N4O4S2
Exact Mass 492.092597 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPjqDk4aVAJ
Name 2-[2-(3,4-Dimethoxyphenyl)-1-(4-oxo-4,5-dihydrothiazol-2-yl)vinyl]-5-cinnamoylamino-1,3,4-thiadiazole
Appearance Pale yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20N4O4S2
InChI InChI=1S/C24H20N4O4S2/c1-31-18-10-8-16(13-19(18)32-2)12-17(22-25-21(30)14-33-22)23-27-28-24(34-23)26-20(29)11-9-15-6-4-3-5-7-15/h3-13H,14H2,1-2H3,(H,26,28,29)
InChIKey NRHTZDUSHWVAPN-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP-1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2824
Molecular Weight 492.568 g/mol
SMILES N(c1sc(C(=Cc2cc(c(OC)cc2)OC)C=2SCC(N2)=O)nn1)C(C=Cc1ccccc1)=O
SPLASH splash10-0udi-2910000000-c08c9f14d6be04467776
Source of Spectrum Y-54-2358-8
Wiley ID 1878439