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N-{(5Z)-5-[(1-methyl-1H-pyrrol-2-yl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-3-nitrobenzamide
SpectraBase Compound ID 57vOC6okM2o
InChI InChI=1S/C16H12N4O4S2/c1-18-7-3-6-11(18)9-13-15(22)19(16(25)26-13)17-14(21)10-4-2-5-12(8-10)20(23)24/h2-9H,1H3,(H,17,21)/b13-9-
InChIKey WRQWHLNFRYPROV-LCYFTJDESA-N
Mol Weight 388.42 g/mol
Molecular Formula C16H12N4O4S2
Exact Mass 388.029997 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8bZvhlXQLRS
Name N-{(5Z)-5-[(1-methyl-1H-pyrrol-2-yl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-3-nitrobenzamide
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/C16H12N4O4S2/c1-18-7-3-6-11(18)9-13-15(22)19(16(25)26-13)17-14(21)10-4-2-5-12(8-10)20(23)24/h2-9H,1H3,(H,17,21)/b13-9-
InChIKey WRQWHLNFRYPROV-LCYFTJDESA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20960
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: D51131; Labnumber: GORPS-081-5127; SBI_ID: SBI-020964
Synonyms N-{5-[(1-methyl-1H-pyrrol-2-yl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-3-nitrobenzamide
Temperature 308 °C