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N-(3-acetylphenyl)-2-{[5-cyano-4-(3-methoxyphenyl)-6-oxo-1,6-dihydro-2-pyrimidinyl]sulfanyl}butanamide
SpectraBase Compound ID LEwk6YZk3yO
InChI InChI=1S/C24H22N4O4S/c1-4-20(23(31)26-17-9-5-7-15(11-17)14(2)29)33-24-27-21(19(13-25)22(30)28-24)16-8-6-10-18(12-16)32-3/h5-12,20H,4H2,1-3H3,(H,26,31)(H,27,28,30)
InChIKey UNAFKZLBLWRTQK-UHFFFAOYSA-N
Mol Weight 462.52 g/mol
Molecular Formula C24H22N4O4S
Exact Mass 462.136176 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LCbofv2OYKg
Name N-(3-acetylphenyl)-2-{[5-cyano-4-(3-methoxyphenyl)-6-oxo-1,6-dihydro-2-pyrimidinyl]sulfanyl}butanamide
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/C24H22N4O4S/c1-4-20(23(31)26-17-9-5-7-15(11-17)14(2)29)33-24-27-21(19(13-25)22(30)28-24)16-8-6-10-18(12-16)32-3/h5-12,20H,4H2,1-3H3,(H,26,31)(H,27,28,30)
InChIKey UNAFKZLBLWRTQK-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_160
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: UZI/9121198; Labnumber: 1691; UZI_ID: UZI-000161
Temperature 315 °C