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1-{4-[(5-bromo-2-thienyl)sulfonyl]-1-piperazinyl}-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile
SpectraBase Compound ID 5CIpPJa9asA
InChI InChI=1S/C23H22BrN5O2S2/c1-2-5-16-14-21(29-19-7-4-3-6-18(19)26-23(29)17(16)15-25)27-10-12-28(13-11-27)33(30,31)22-9-8-20(24)32-22/h3-4,6-9,14H,2,5,10-13H2,1H3
InChIKey ATFBZHJCUCGOQB-UHFFFAOYSA-N
Mol Weight 544.49 g/mol
Molecular Formula C23H22BrN5O2S2
Exact Mass 543.03983 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AgdZuUcvhV5
Name 1-{4-[(5-bromo-2-thienyl)sulfonyl]-1-piperazinyl}-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile
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/C23H22BrN5O2S2/c1-2-5-16-14-21(29-19-7-4-3-6-18(19)26-23(29)17(16)15-25)27-10-12-28(13-11-27)33(30,31)22-9-8-20(24)32-22/h3-4,6-9,14H,2,5,10-13H2,1H3
InChIKey ATFBZHJCUCGOQB-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1256
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: C95518; Labnumber: POPOV-3380; SBI_ID: SBI-001258
Temperature 306 °C