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4-(2-{[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}ethyl)-N-methyl-1-piperazinecarbothioamide
SpectraBase Compound ID 8L4EaJrinnj
InChI InChI=1S/C13H20N6O2S2/c1-14-13(23)19-6-4-18(5-7-19)3-2-15-8-9-10(20)16-12(22)17-11(9)21/h8,15H,2-7H2,1H3,(H,14,23)(H2,16,17,20,21,22)
InChIKey RPPSTYJXXIRIDK-UHFFFAOYSA-N
Mol Weight 356.46 g/mol
Molecular Formula C13H20N6O2S2
Exact Mass 356.108916 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LFvRlo2ERPp
Name 4-(2-{[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}ethyl)-N-methyl-1-piperazinecarbothioamide
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/C13H20N6O2S2/c1-14-13(23)19-6-4-18(5-7-19)3-2-15-8-9-10(20)16-12(22)17-11(9)21/h8,15H,2-7H2,1H3,(H,14,23)(H2,16,17,20,21,22)
InChIKey RPPSTYJXXIRIDK-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17599
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: D28738; Labnumber: KKA-0211-2170; SBI_ID: SBI-017602
Temperature 308 °C