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ethyl 4-{2-[2-(benzylamino)-2-oxoethoxy]phenyl}-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID JxbcKxusrh1
InChI InChI=1S/C23H25N3O4S/c1-3-29-22(28)20-15(2)25-23(31)26-21(20)17-11-7-8-12-18(17)30-14-19(27)24-13-16-9-5-4-6-10-16/h4-12,21H,3,13-14H2,1-2H3,(H,24,27)(H2,25,26,31)
InChIKey AQXXALMZFUQTLT-UHFFFAOYSA-N
Mol Weight 439.53 g/mol
Molecular Formula C23H25N3O4S
Exact Mass 439.156577 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID x9q7IuFMHp
Name ethyl 4-{2-[2-(benzylamino)-2-oxoethoxy]phenyl}-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
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/C23H25N3O4S/c1-3-29-22(28)20-15(2)25-23(31)26-21(20)17-11-7-8-12-18(17)30-14-19(27)24-13-16-9-5-4-6-10-16/h4-12,21H,3,13-14H2,1-2H3,(H,24,27)(H2,25,26,31)
InChIKey AQXXALMZFUQTLT-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34815
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: 9501595; SBI_ID: SBI-034819
Temperature 308 °C