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(6Z)-5-imino-6-{4-[2-(4-methylphenoxy)ethoxy]benzylidene}-2-(3-pyridinyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID H0WOR5ZpgLn
InChI InChI=1S/C26H21N5O3S/c1-17-4-8-20(9-5-17)33-13-14-34-21-10-6-18(7-11-21)15-22-23(27)31-26(29-24(22)32)35-25(30-31)19-3-2-12-28-16-19/h2-12,15-16,27H,13-14H2,1H3/b22-15-,27-23?
InChIKey GAXMDGGHMRANCN-KLUMOMIWSA-N
Mol Weight 483.55 g/mol
Molecular Formula C26H21N5O3S
Exact Mass 483.136511 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JyfgxOu2rOZ
Name (6Z)-5-imino-6-{4-[2-(4-methylphenoxy)ethoxy]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/C26H21N5O3S/c1-17-4-8-20(9-5-17)33-13-14-34-21-10-6-18(7-11-21)15-22-23(27)31-26(29-24(22)32)35-25(30-31)19-3-2-12-28-16-19/h2-12,15-16,27H,13-14H2,1H3/b22-15-,27-23?
InChIKey GAXMDGGHMRANCN-KLUMOMIWSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21585
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: D55102; Labnumber: CEP5-0322; SBI_ID: SBI-021589
Synonyms 5-imino-6-{4-[2-(4-methylphenoxy)ethoxy]benzylidene}-2-(3-pyridinyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 315 °C