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4(3H)-pyrimidinone, 6-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-(4-methyl-1-piperazinyl)-
SpectraBase Compound ID 3CgP9BioRal
InChI InChI=1S/C12H17N7OS2/c1-18-2-4-19(5-3-18)11-14-8(6-9(20)15-11)7-21-12-17-16-10(13)22-12/h6H,2-5,7H2,1H3,(H2,13,16)(H,14,15,20)
InChIKey XZWZAAQEQLYNIY-UHFFFAOYSA-N
Mol Weight 339.44 g/mol
Molecular Formula C12H17N7OS2
Exact Mass 339.093601 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2uIFP2Hmmd
Name 4(3H)-pyrimidinone, 6-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-(4-methyl-1-piperazinyl)-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C12H17N7OS2/c1-18-2-4-19(5-3-18)11-14-8(6-9(20)15-11)7-21-12-17-16-10(13)22-12/h6H,2-5,7H2,1H3,(H2,13,16)(H,14,15,20)
InChIKey XZWZAAQEQLYNIY-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3706
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F18108; Labnumber: VGU-106555