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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-2-(1-methylethyl)-6-[[4-[2-(4-methylphenoxy)ethoxy]phenyl]methylene]-, (6Z)-
SpectraBase Compound ID 4Tk9Wpj3wvy
InChI InChI=1S/C24H24N4O3S/c1-15(2)23-27-28-21(25)20(22(29)26-24(28)32-23)14-17-6-10-19(11-7-17)31-13-12-30-18-8-4-16(3)5-9-18/h4-11,14-15,25H,12-13H2,1-3H3/b20-14-,25-21?
InChIKey JXBGKONVKPCSMC-OEMPCWLZSA-N
Mol Weight 448.54 g/mol
Molecular Formula C24H24N4O3S
Exact Mass 448.156912 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IUNjbax5NV5
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-2-(1-methylethyl)-6-[[4-[2-(4-methylphenoxy)ethoxy]phenyl]methylene]-, (6Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 448.156911820 u
Formula C24H24N4O3S
InChI InChI=1S/C24H24N4O3S/c1-15(2)23-27-28-21(25)20(22(29)26-24(28)32-23)14-17-6-10-19(11-7-17)31-13-12-30-18-8-4-16(3)5-9-18/h4-11,14-15,25H,12-13H2,1-3H3/b20-14-,25-21?
InChIKey JXBGKONVKPCSMC-OEMPCWLZSA-N
Molecular Weight 448.541 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15576
Solvent DMSO-d6
Source Vendor ID: ZI/10033013; Lab Info: CEP; Lab Number: CEP-6700236