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(2E)-2-cyano-N-(3,4-dimethylphenyl)-2-[(5E)-4-oxo-3-phenyl-5-(2-thienylmethylene)-1,3-thiazolidin-2-ylidene]ethanamide
SpectraBase Compound ID 8obWmTtJHWE
InChI InChI=1S/C25H19N3O2S2/c1-16-10-11-18(13-17(16)2)27-23(29)21(15-26)25-28(19-7-4-3-5-8-19)24(30)22(32-25)14-20-9-6-12-31-20/h3-14H,1-2H3,(H,27,29)/b22-14+,25-21+
InChIKey LLMLZDBJNGQYRS-BSKLEVBYSA-N
Mol Weight 457.57 g/mol
Molecular Formula C25H19N3O2S2
Exact Mass 457.091869 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2AeagO3xNcQ
Name (2E)-2-cyano-N-(3,4-dimethylphenyl)-2-[(5E)-4-oxo-3-phenyl-5-(2-thienylmethylene)-1,3-thiazolidin-2-ylidene]ethanamide
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/C25H19N3O2S2/c1-16-10-11-18(13-17(16)2)27-23(29)21(15-26)25-28(19-7-4-3-5-8-19)24(30)22(32-25)14-20-9-6-12-31-20/h3-14H,1-2H3,(H,27,29)/b22-14+,25-21+
InChIKey LLMLZDBJNGQYRS-BSKLEVBYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26721
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: D66562; Labnumber: EXP17Mat000983; SBI_ID: SBI-026725
Synonyms 2-cyano-N-(3,4-dimethylphenyl)-2-[4-oxo-3-phenyl-5-(2-thienylmethylene)-1,3-thiazolidin-2-ylidene]ethanamide
Temperature 318 °C