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(5Z)-1-cyclopropyl-5-{[(1-phenylethyl)amino]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID F87BW6bnEBb
InChI InChI=1S/C16H17N3O2S/c1-10(11-5-3-2-4-6-11)17-9-13-14(20)18-16(22)19(15(13)21)12-7-8-12/h2-6,9-10,12,17H,7-8H2,1H3,(H,18,20,22)/b13-9-
InChIKey YREKWSCGOZYAQQ-LCYFTJDESA-N
Mol Weight 315.39 g/mol
Molecular Formula C16H17N3O2S
Exact Mass 315.104148 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AQBMjajsXVE
Name (5Z)-1-cyclopropyl-5-{[(1-phenylethyl)amino]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C16H17N3O2S/c1-10(11-5-3-2-4-6-11)17-9-13-14(20)18-16(22)19(15(13)21)12-7-8-12/h2-6,9-10,12,17H,7-8H2,1H3,(H,18,20,22)/b13-9-
InChIKey YREKWSCGOZYAQQ-LCYFTJDESA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27599
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: D77209; Labnumber: KKA-0212C-0926; SBI_ID: SBI-027603
Synonyms 1-cyclopropyl-5-{[(1-phenylethyl)amino]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 308 °C