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(6Z)-5-imino-6-{[1-(2-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-
SpectraBase Compound ID 9Qa5T6Ue7qu
InChI InChI=1S/C20H19N5O2S2/c1-11-9-13(12(2)24(11)15-7-5-6-8-16(15)27-3)10-14-17(21)25-19(22-18(14)26)29-23-20(25)28-4/h5-10,21H,1-4H3/b14-10-,21-17?
InChIKey GMFFWAORMYPEQR-QBILMKHKSA-N
Mol Weight 425.53 g/mol
Molecular Formula C20H19N5O2S2
Exact Mass 425.098017 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DCh2AYDx3q3
Name (6Z)-5-imino-6-{[1-(2-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 425.098017218 u
Formula C20H19N5O2S2
InChI InChI=1S/C20H19N5O2S2/c1-11-9-13(12(2)24(11)15-7-5-6-8-16(15)27-3)10-14-17(21)25-19(22-18(14)26)29-23-20(25)28-4/h5-10,21H,1-4H3/b14-10-,21-17?
InChIKey GMFFWAORMYPEQR-QBILMKHKSA-N
Molecular Weight 425.525 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_174
Solvent DMSO-d6
Source Vendor ID: NMR/12259832