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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(2-chlorophenoxy)ethoxy]phenyl]methylene]-5,6-dihydro-5-imino-2-(2-methylpropyl)-, (6Z)-
SpectraBase Compound ID mPPGrun2VZ
InChI InChI=1S/C24H23ClN4O3S/c1-15(2)13-21-28-29-22(26)18(23(30)27-24(29)33-21)14-16-7-9-17(10-8-16)31-11-12-32-20-6-4-3-5-19(20)25/h3-10,14-15,26H,11-13H2,1-2H3/b18-14-,26-22?
InChIKey VHTPWMKHTUMQIQ-UIBINATQSA-N
Mol Weight 482.99 g/mol
Molecular Formula C24H23ClN4O3S
Exact Mass 482.117939 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IF95i2K3Tph
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(2-chlorophenoxy)ethoxy]phenyl]methylene]-5,6-dihydro-5-imino-2-(2-methylpropyl)-, (6Z)-
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/C24H23ClN4O3S/c1-15(2)13-21-28-29-22(26)18(23(30)27-24(29)33-21)14-16-7-9-17(10-8-16)31-11-12-32-20-6-4-3-5-19(20)25/h3-10,14-15,26H,11-13H2,1-2H3/b18-14-,26-22?
InChIKey VHTPWMKHTUMQIQ-UIBINATQSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2594
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: NMR/11269268