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(5Z)-5-{[3-(2,5-dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-2-thioxo-1,3-thiazolidin-4-one
SpectraBase Compound ID pkSeWlMtAT
InChI InChI=1S/C21H17N3OS2/c1-13-8-9-14(2)17(10-13)19-15(11-18-20(25)22-21(26)27-18)12-24(23-19)16-6-4-3-5-7-16/h3-12H,1-2H3,(H,22,25,26)/b18-11-
InChIKey NHWNTGVVCVJWSW-WQRHYEAKSA-N
Mol Weight 391.51 g/mol
Molecular Formula C21H17N3OS2
Exact Mass 391.081305 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3VUcN7L8OAg
Name (5Z)-5-{[3-(2,5-dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-2-thioxo-1,3-thiazolidin-4-one
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/C21H17N3OS2/c1-13-8-9-14(2)17(10-13)19-15(11-18-20(25)22-21(26)27-18)12-24(23-19)16-6-4-3-5-7-16/h3-12H,1-2H3,(H,22,25,26)/b18-11-
InChIKey NHWNTGVVCVJWSW-WQRHYEAKSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_6321
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: 123199; Labnumber: EX00116378; VK_ID: VK-006324
Synonyms 5-{[3-(2,5-dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-2-thioxo-1,3-thiazolidin-4-one
Temperature 318 °C