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(6Z)-6-[4-(dimethylamino)benzylidene]-5-imino-3-(isobutylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
SpectraBase Compound ID 99FnabDoY5a
InChI InChI=1S/C18H21N5OS2/c1-11(2)10-25-18-21-26-17-20-16(24)14(15(19)23(17)18)9-12-5-7-13(8-6-12)22(3)4/h5-9,11,19H,10H2,1-4H3/b14-9-,19-15?
InChIKey BBPGDXNIIRCELU-PYDVBCTCSA-N
Mol Weight 387.52 g/mol
Molecular Formula C18H21N5OS2
Exact Mass 387.118753 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JZeUAYYM1vI
Name (6Z)-6-[4-(dimethylamino)benzylidene]-5-imino-3-(isobutylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 387.118752663 u
Formula C18H21N5OS2
InChI InChI=1S/C18H21N5OS2/c1-11(2)10-25-18-21-26-17-20-16(24)14(15(19)23(17)18)9-12-5-7-13(8-6-12)22(3)4/h5-9,11,19H,10H2,1-4H3/b14-9-,19-15?
InChIKey BBPGDXNIIRCELU-PYDVBCTCSA-N
Molecular Weight 387.520 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_192
Solvent DMSO-d6
Source Vendor ID: NMR/12259850