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4-{2,5-dimethyl-3-[(Z)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-1H-pyrrol-1-yl}benzenesulfonamide
SpectraBase Compound ID APGwZ7kdKVm
InChI InChI=1S/C22H18N4O3S2/c1-13-11-15(14(2)25(13)16-7-9-17(10-8-16)31(23,28)29)12-20-21(27)26-19-6-4-3-5-18(19)24-22(26)30-20/h3-12H,1-2H3,(H2,23,28,29)/b20-12-
InChIKey YIAFXALCTWNVIV-NDENLUEZSA-N
Mol Weight 450.53 g/mol
Molecular Formula C22H18N4O3S2
Exact Mass 450.082033 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EJVlUJKN2PF
Name 4-{2,5-dimethyl-3-[(Z)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-1H-pyrrol-1-yl}benzenesulfonamide
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/C22H18N4O3S2/c1-13-11-15(14(2)25(13)16-7-9-17(10-8-16)31(23,28)29)12-20-21(27)26-19-6-4-3-5-18(19)24-22(26)30-20/h3-12H,1-2H3,(H2,23,28,29)/b20-12-
InChIKey YIAFXALCTWNVIV-NDENLUEZSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22855
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: D35983; Labnumber: SPDEM4-19183; SBI_ID: SBI-022859
Synonyms 4-{2,5-dimethyl-3-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-1H-pyrrol-1-yl}benzenesulfonamide
Temperature 315 °C