For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(6Z)-6-[4-(benzyloxy)-3-chlorobenzylidene]-5-imino-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID Bkb8ucqZLyC
InChI InChI=1S/C25H22ClN5O3S/c26-19-13-17(8-9-20(19)34-15-16-6-2-1-3-7-16)12-18-23(27)31-25(28-24(18)33)35-21(29-31)14-22(32)30-10-4-5-11-30/h1-3,6-9,12-13,27H,4-5,10-11,14-15H2/b18-12-,27-23?
InChIKey FVDGJSZWFFPFAE-ADZLKVMLSA-N
Mol Weight 508.0 g/mol
Molecular Formula C25H22ClN5O3S
Exact Mass 507.113188 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GrujT4yBI9I
Name (6Z)-6-[4-(benzyloxy)-3-chlorobenzylidene]-5-imino-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]-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/C25H22ClN5O3S/c26-19-13-17(8-9-20(19)34-15-16-6-2-1-3-7-16)12-18-23(27)31-25(28-24(18)33)35-21(29-31)14-22(32)30-10-4-5-11-30/h1-3,6-9,12-13,27H,4-5,10-11,14-15H2/b18-12-,27-23?
InChIKey FVDGJSZWFFPFAE-ADZLKVMLSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21593
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: D55116; Labnumber: CEP5-0550; SBI_ID: SBI-021597
Synonyms 6-[4-(benzyloxy)-3-chlorobenzylidene]-5-imino-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 315 °C