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2-tert-butyl 4-ethyl 5-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-3-methyl-2,4-thiophenedicarboxylate

View entire compound with spectra: 1 NMR

2-tert-butyl 4-ethyl 5-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-3-methyl-2,4-thiophenedicarboxylate
SpectraBase Compound ID LPPHy5jFRrb
InChI InChI=1S/C26H25N3O6S2/c1-6-32-24(30)20-14(2)21(25(31)35-26(3,4)5)37-23(20)28-11-16(10-27)22-29-17(12-36-22)15-7-8-18-19(9-15)34-13-33-18/h7-9,11-12,28H,6,13H2,1-5H3/b16-11-
InChIKey MBJQFFLVCAFWDE-WJDWOHSUSA-N
Mol Weight 539.62 g/mol
Molecular Formula C26H25N3O6S2
Exact Mass 539.118478 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JsIcZC4Wj39
Name 2-tert-butyl 4-ethyl 5-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-3-methyl-2,4-thiophenedicarboxylate
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/C26H25N3O6S2/c1-6-32-24(30)20-14(2)21(25(31)35-26(3,4)5)37-23(20)28-11-16(10-27)22-29-17(12-36-22)15-7-8-18-19(9-15)34-13-33-18/h7-9,11-12,28H,6,13H2,1-5H3/b16-11-
InChIKey MBJQFFLVCAFWDE-WJDWOHSUSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21962
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: D58095; Labnumber: ULGA9-0128; SBI_ID: SBI-021966
Synonyms 2-tert-butyl 4-ethyl 5-({2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-3-methyl-2,4-thiophenedicarboxylate
Temperature 308 °C