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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 2-heptyl-5,6-dihydro-6-[(4-hydroxy-3-methoxyphenyl)methylene]-5-imino-, (6Z)-
SpectraBase Compound ID 2uTdw6x16FG
InChI InChI=1S/C20H24N4O3S/c1-3-4-5-6-7-8-17-23-24-18(21)14(19(26)22-20(24)28-17)11-13-9-10-15(25)16(12-13)27-2/h9-12,21,25H,3-8H2,1-2H3/b14-11-,21-18?
InChIKey KIBYASJKHOFMMA-KFMVTFPESA-N
Mol Weight 400.5 g/mol
Molecular Formula C20H24N4O3S
Exact Mass 400.156912 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3LqNR45l425
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 2-heptyl-5,6-dihydro-6-[(4-hydroxy-3-methoxyphenyl)methylene]-5-imino-, (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 400.156911820 u
Formula C20H24N4O3S
InChI InChI=1S/C20H24N4O3S/c1-3-4-5-6-7-8-17-23-24-18(21)14(19(26)22-20(24)28-17)11-13-9-10-15(25)16(12-13)27-2/h9-12,21,25H,3-8H2,1-2H3/b14-11-,21-18?
InChIKey KIBYASJKHOFMMA-KFMVTFPESA-N
Molecular Weight 400.497 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15566
Solvent DMSO-d6
Source Vendor ID: ZI/10031542; Lab Info: CEP; Lab Number: CEP-6700111