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2-[4-(5-acetyl-6-phenyl-2-thioxo-1,2,3,4-tetrahydro-4-pyrimidinyl)-2-chloro-6-methoxyphenoxy]-N-phenylacetamide
SpectraBase Compound ID DN84JuZhyZo
InChI InChI=1S/C27H24ClN3O4S/c1-16(32)23-24(17-9-5-3-6-10-17)30-27(36)31-25(23)18-13-20(28)26(21(14-18)34-2)35-15-22(33)29-19-11-7-4-8-12-19/h3-14,25H,15H2,1-2H3,(H,29,33)(H2,30,31,36)
InChIKey XDXSXBULAVBQNV-UHFFFAOYSA-N
Mol Weight 522.02 g/mol
Molecular Formula C27H24ClN3O4S
Exact Mass 521.117605 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3CKS4nfdPlX
Name 2-[4-(5-acetyl-6-phenyl-2-thioxo-1,2,3,4-tetrahydro-4-pyrimidinyl)-2-chloro-6-methoxyphenoxy]-N-phenylacetamide
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/C27H24ClN3O4S/c1-16(32)23-24(17-9-5-3-6-10-17)30-27(36)31-25(23)18-13-20(28)26(21(14-18)34-2)35-15-22(33)29-19-11-7-4-8-12-19/h3-14,25H,15H2,1-2H3,(H,29,33)(H2,30,31,36)
InChIKey XDXSXBULAVBQNV-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34825
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: 9562592; SBI_ID: SBI-034829
Temperature 308 °C