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4-{4-[2-(benzylamino)-2-oxoethoxy]-3-methoxyphenyl}-N-(2-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide

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4-{4-[2-(benzylamino)-2-oxoethoxy]-3-methoxyphenyl}-N-(2-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
SpectraBase Compound ID 9hPFmMNGaO7
InChI InChI=1S/C29H30N4O5S/c1-18-26(28(35)32-21-11-7-8-12-22(21)36-2)27(33-29(39)31-18)20-13-14-23(24(15-20)37-3)38-17-25(34)30-16-19-9-5-4-6-10-19/h4-15,27H,16-17H2,1-3H3,(H,30,34)(H,32,35)(H2,31,33,39)
InChIKey JHKMMPPSCJRDCK-UHFFFAOYSA-N
Mol Weight 546.64 g/mol
Molecular Formula C29H30N4O5S
Exact Mass 546.193691 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JSDPXWLwcwr
Name 4-{4-[2-(benzylamino)-2-oxoethoxy]-3-methoxyphenyl}-N-(2-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
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/C29H30N4O5S/c1-18-26(28(35)32-21-11-7-8-12-22(21)36-2)27(33-29(39)31-18)20-13-14-23(24(15-20)37-3)38-17-25(34)30-16-19-9-5-4-6-10-19/h4-15,27H,16-17H2,1-3H3,(H,30,34)(H,32,35)(H2,31,33,39)
InChIKey JHKMMPPSCJRDCK-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31535
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: 1842984; SBI_ID: SBI-031539
Temperature 306 °C