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ethyl 5-acetyl-2-({(Z)-2-cyano-2-[4-(4-isobutylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methyl-3-thiophenecarboxylate
SpectraBase Compound ID EdlrPDwYaJA
InChI InChI=1S/C26H27N3O3S2/c1-6-32-26(31)22-16(4)23(17(5)30)34-25(22)28-13-20(12-27)24-29-21(14-33-24)19-9-7-18(8-10-19)11-15(2)3/h7-10,13-15,28H,6,11H2,1-5H3/b20-13-
InChIKey NXQQJTWGOHWSDC-MOSHPQCFSA-N
Mol Weight 493.64 g/mol
Molecular Formula C26H27N3O3S2
Exact Mass 493.149384 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 88IMA8vFPg3
Name ethyl 5-acetyl-2-({(Z)-2-cyano-2-[4-(4-isobutylphenyl)-1,3-thiazol-2-yl]ethenyl}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/C26H27N3O3S2/c1-6-32-26(31)22-16(4)23(17(5)30)34-25(22)28-13-20(12-27)24-29-21(14-33-24)19-9-7-18(8-10-19)11-15(2)3/h7-10,13-15,28H,6,11H2,1-5H3/b20-13-
InChIKey NXQQJTWGOHWSDC-MOSHPQCFSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23688
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: D43447; Labnumber: ULGA9-0014; SBI_ID: SBI-023692
Synonyms ethyl 5-acetyl-2-({2-cyano-2-[4-(4-isobutylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methyl-3-thiophenecarboxylate
Temperature 318 °C