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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-, (6Z)-
SpectraBase Compound ID K7cwN3eEthu
InChI InChI=1S/C25H26N4O3S/c1-15(2)24-28-29-22(26)21(23(30)27-25(29)33-24)14-18-6-9-19(10-7-18)31-11-12-32-20-8-5-16(3)17(4)13-20/h5-10,13-15,26H,11-12H2,1-4H3/b21-14-,26-22?
InChIKey FQKJMQOCUJVOKG-TUKHXMGSSA-N
Mol Weight 462.57 g/mol
Molecular Formula C25H26N4O3S
Exact Mass 462.172562 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6XloxawkzJV
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(3,4-dimethylphenoxy)ethoxy]phenyl]methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-, (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/C25H26N4O3S/c1-15(2)24-28-29-22(26)21(23(30)27-25(29)33-24)14-18-6-9-19(10-7-18)31-11-12-32-20-8-5-16(3)17(4)13-20/h5-10,13-15,26H,11-12H2,1-4H3/b21-14-,26-22?
InChIKey FQKJMQOCUJVOKG-TUKHXMGSSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2954
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: ZI/10031729; Labnumber: CEP-6700287