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(6Z)-5-imino-6-{4-[(2-nitrobenzyl)oxy]benzylidene}-2-(3-pyridinyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID 6VJait0fgOa
InChI InChI=1S/C24H16N6O4S/c25-21-19(22(31)27-24-29(21)28-23(35-24)16-5-3-11-26-13-16)12-15-7-9-18(10-8-15)34-14-17-4-1-2-6-20(17)30(32)33/h1-13,25H,14H2/b19-12-,25-21?
InChIKey GTPQHJNIDBJYFH-OSZNWEDFSA-N
Mol Weight 484.49 g/mol
Molecular Formula C24H16N6O4S
Exact Mass 484.095374 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LGLRDF6fxgi
Name (6Z)-5-imino-6-{4-[(2-nitrobenzyl)oxy]benzylidene}-2-(3-pyridinyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-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/C24H16N6O4S/c25-21-19(22(31)27-24-29(21)28-23(35-24)16-5-3-11-26-13-16)12-15-7-9-18(10-8-15)34-14-17-4-1-2-6-20(17)30(32)33/h1-13,25H,14H2/b19-12-,25-21?
InChIKey GTPQHJNIDBJYFH-OSZNWEDFSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21586
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: D55104; Labnumber: CEP5-0334; SBI_ID: SBI-021590
Synonyms 5-imino-6-{4-[(2-nitrobenzyl)oxy]benzylidene}-2-(3-pyridinyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 315 °C