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5-[(1,5-dimethyl-1H-pyrazol-4-yl)methylene]-1,3-diphenyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID 445yuiPmTzz
InChI InChI=1S/C22H18N4O2S/c1-15-16(14-23-24(15)2)13-19-20(27)25(17-9-5-3-6-10-17)22(29)26(21(19)28)18-11-7-4-8-12-18/h3-14H,1-2H3
InChIKey KMFFVOTWHWDVCS-UHFFFAOYSA-N
Mol Weight 402.47 g/mol
Molecular Formula C22H18N4O2S
Exact Mass 402.115047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4gkZDuKQPKV
Name 5-[(1,5-dimethyl-1H-pyrazol-4-yl)methylene]-1,3-diphenyl-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/C22H18N4O2S/c1-15-16(14-23-24(15)2)13-19-20(27)25(17-9-5-3-6-10-17)22(29)26(21(19)28)18-11-7-4-8-12-18/h3-14H,1-2H3
InChIKey KMFFVOTWHWDVCS-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_7006
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: 9686321; UBI_ID: UBI-007008
Temperature 308 °C