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ethyl 5-acetyl-2-({(Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-4-methyl-3-thiophenecarboxylate
SpectraBase Compound ID 8m31lrruGFn
InChI InChI=1S/C22H18BrN3O3S2/c1-4-29-22(28)18-12(2)19(13(3)27)31-21(18)25-10-15(9-24)20-26-17(11-30-20)14-5-7-16(23)8-6-14/h5-8,10-11,25H,4H2,1-3H3/b15-10-
InChIKey BWPRMVIKTMTPLL-GDNBJRDFSA-N
Mol Weight 516.43 g/mol
Molecular Formula C22H18BrN3O3S2
Exact Mass 514.997297 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 47h7EUHJz5b
Name ethyl 5-acetyl-2-({(Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-4-methyl-3-thiophenecarboxylate
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/C22H18BrN3O3S2/c1-4-29-22(28)18-12(2)19(13(3)27)31-21(18)25-10-15(9-24)20-26-17(11-30-20)14-5-7-16(23)8-6-14/h5-8,10-11,25H,4H2,1-3H3/b15-10-
InChIKey BWPRMVIKTMTPLL-GDNBJRDFSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23683
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: D43440; Labnumber: ULGA9-0006; SBI_ID: SBI-023687
Synonyms ethyl 5-acetyl-2-({2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-4-methyl-3-thiophenecarboxylate
Temperature 318 °C