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(2E)-2-cyano-N-(4-isopropylphenyl)-2-[(5E)-5-(4-nitrobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
SpectraBase Compound ID HyPqUZg0fHL
InChI InChI=1S/C28H22N4O4S/c1-18(2)20-10-12-21(13-11-20)30-26(33)24(17-29)28-31(22-6-4-3-5-7-22)27(34)25(37-28)16-19-8-14-23(15-9-19)32(35)36/h3-16,18H,1-2H3,(H,30,33)/b25-16+,28-24+
InChIKey AVUSDZWUSIFBMM-CZRYGKRYSA-N
Mol Weight 510.57 g/mol
Molecular Formula C28H22N4O4S
Exact Mass 510.136176 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CfD3EvfwRgg
Name (2E)-2-cyano-N-(4-isopropylphenyl)-2-[(5E)-5-(4-nitrobenzylidene)-4-oxo-3-phenyl-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/C28H22N4O4S/c1-18(2)20-10-12-21(13-11-20)30-26(33)24(17-29)28-31(22-6-4-3-5-7-22)27(34)25(37-28)16-19-8-14-23(15-9-19)32(35)36/h3-16,18H,1-2H3,(H,30,33)/b25-16+,28-24+
InChIKey AVUSDZWUSIFBMM-CZRYGKRYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26736
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: D66592; Labnumber: EXP17Mat001098; SBI_ID: SBI-026740
Synonyms 2-cyano-N-(4-isopropylphenyl)-2-[5-(4-nitrobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide
Temperature 318 °C