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(2Z)-2-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
SpectraBase Compound ID JBr16kvSxAn
InChI InChI=1S/C22H16N4O3S/c1-13-11-15(14(2)24(13)16-7-9-17(10-8-16)26(28)29)12-20-21(27)25-19-6-4-3-5-18(19)23-22(25)30-20/h3-12H,1-2H3/b20-12-
InChIKey VREHXKPBVVZDDM-NDENLUEZSA-N
Mol Weight 416.46 g/mol
Molecular Formula C22H16N4O3S
Exact Mass 416.094312 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DMj0ehZIA4q
Name (2Z)-2-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-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/C22H16N4O3S/c1-13-11-15(14(2)24(13)16-7-9-17(10-8-16)26(28)29)12-20-21(27)25-19-6-4-3-5-18(19)23-22(25)30-20/h3-12H,1-2H3/b20-12-
InChIKey VREHXKPBVVZDDM-NDENLUEZSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_21194
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: UZI/9677332; UBI_ID: UBI-021198
Synonyms 2-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Temperature 318 °C