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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(3,4-dimethylphenoxy)ethoxy]-3-methoxyphenyl]methylene]-5,6-dihydro-5-imino-2-(1-
SpectraBase Compound ID JXzrRT0cqW1
InChI InChI=1S/C26H28N4O4S/c1-15(2)25-29-30-23(27)20(24(31)28-26(30)35-25)13-18-7-9-21(22(14-18)32-5)34-11-10-33-19-8-6-16(3)17(4)12-19/h6-9,12-15,27H,10-11H2,1-5H3/b20-13-,27-23?
InChIKey DPZIZCJGFFWULB-KZVRHOHFSA-N
Mol Weight 492.59 g/mol
Molecular Formula C26H28N4O4S
Exact Mass 492.183127 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A3DkQcYMoyO
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[4-[2-(3,4-dimethylphenoxy)ethoxy]-3-methoxyphenyl]methylene]-5,6-dihydro-5-imino-2-(1-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 492.183126568 u
Formula C26H28N4O4S
InChI InChI=1S/C26H28N4O4S/c1-15(2)25-29-30-23(27)20(24(31)28-26(30)35-25)13-18-7-9-21(22(14-18)32-5)34-11-10-33-19-8-6-16(3)17(4)12-19/h6-9,12-15,27H,10-11H2,1-5H3/b20-13-,27-23?
InChIKey DPZIZCJGFFWULB-KZVRHOHFSA-N
Molecular Weight 492.594 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17081
Solvent DMSO-d6
Source Vendor ID: ZI/10033976; Lab Info: CEP; Lab Number: CEP-6700488