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N-(4-{[(E)-(1-sec-butyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}phenyl)acetamide
SpectraBase Compound ID 9b1Dx8dMV7V
InChI InChI=1S/C17H20N4O3S/c1-4-10(2)21-16(24)14(15(23)20-17(21)25)9-18-12-5-7-13(8-6-12)19-11(3)22/h5-10,18H,4H2,1-3H3,(H,19,22)(H,20,23,25)/b14-9+
InChIKey RWZQKSZSMNFZLL-NTEUORMPSA-N
Mol Weight 360.43 g/mol
Molecular Formula C17H20N4O3S
Exact Mass 360.125612 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EBEBUPWTHNa
Name N-(4-{[(E)-(1-sec-butyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}phenyl)acetamide
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/C17H20N4O3S/c1-4-10(2)21-16(24)14(15(23)20-17(21)25)9-18-12-5-7-13(8-6-12)19-11(3)22/h5-10,18H,4H2,1-3H3,(H,19,22)(H,20,23,25)/b14-9+
InChIKey RWZQKSZSMNFZLL-NTEUORMPSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17645
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: D28851; Labnumber: KKA-0211-3785; SBI_ID: SBI-017648
Synonyms N-(4-{[(1-sec-butyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}phenyl)acetamide
Temperature 318 °C