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Ethyl 5-((1-(1H-indol-3-yl)ethylidene)hydrazono)-4-(4-chlorophenyl)-4,5-dihydro-1,3,4-thiadiazole-2-carboxylate
SpectraBase Compound ID BSvIgYY1PQd
InChI InChI=1S/C21H18ClN5O2S/c1-3-29-20(28)19-26-27(15-10-8-14(22)9-11-15)21(30-19)25-24-13(2)17-12-23-18-7-5-4-6-16(17)18/h4-12,23H,3H2,1-2H3
InChIKey RPGSHDPRGQPHQG-UHFFFAOYSA-N
Mol Weight 439.92 g/mol
Molecular Formula C21H18ClN5O2S
Exact Mass 439.086974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5vewe62ZWAf
Name Ethyl 5-((1-(1H-indol-3-yl)ethylidene)hydrazono)-4-(4-chlorophenyl)-4,5-dihydro-1,3,4-thiadiazole-2-carboxylate
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18ClN5O2S
InChI InChI=1S/C21H18ClN5O2S/c1-3-29-20(28)19-26-27(15-10-8-14(22)9-11-15)21(30-19)25-24-13(2)17-12-23-18-7-5-4-6-16(17)18/h4-12,23H,3H2,1-2H3
InChIKey RPGSHDPRGQPHQG-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2740
Molecular Weight 439.921 g/mol
SMILES [nH]1c2c(c(c1)C(=NN=C1SC(C(OCC)=O)=NN1c1ccc(cc1)Cl)C)cccc2
SPLASH splash10-056s-5900000000-fc348acab58dfc43d786
Source of Spectrum Y-54-1535-11f
Wiley ID 1878253