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(6Z)-5-imino-6-(1H-indol-3-ylmethylene)-3-(isobutylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
SpectraBase Compound ID GrnYLABG0FX
InChI InChI=1S/C18H17N5OS2/c1-10(2)9-25-18-22-26-17-21-16(24)13(15(19)23(17)18)7-11-8-20-14-6-4-3-5-12(11)14/h3-8,10,19-20H,9H2,1-2H3/b13-7-,19-15?
InChIKey QZKDRWCBAMLJDA-GVMLJBEOSA-N
Mol Weight 383.49 g/mol
Molecular Formula C18H17N5OS2
Exact Mass 383.087453 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EXWlDyTHFpM
Name (6Z)-5-imino-6-(1H-indol-3-ylmethylene)-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 383.087452534 u
Formula C18H17N5OS2
InChI InChI=1S/C18H17N5OS2/c1-10(2)9-25-18-22-26-17-21-16(24)13(15(19)23(17)18)7-11-8-20-14-6-4-3-5-12(11)14/h3-8,10,19-20H,9H2,1-2H3/b13-7-,19-15?
InChIKey QZKDRWCBAMLJDA-GVMLJBEOSA-N
Molecular Weight 383.488 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_195
Solvent DMSO-d6
Source Vendor ID: NMR/12259853