For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
methyl 4-{[(3-benzyl-1-ethyl-5-oxo-2-thioxo-4-imidazolidinyl)acetyl]amino}benzoate
SpectraBase Compound ID KBoUo6qhAbD
InChI InChI=1S/C22H23N3O4S/c1-3-24-20(27)18(25(22(24)30)14-15-7-5-4-6-8-15)13-19(26)23-17-11-9-16(10-12-17)21(28)29-2/h4-12,18H,3,13-14H2,1-2H3,(H,23,26)
InChIKey CZFPONVBPBSHBI-UHFFFAOYSA-N
Mol Weight 425.5 g/mol
Molecular Formula C22H23N3O4S
Exact Mass 425.140927 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 80fA36ppZXN
Name methyl 4-{[(3-benzyl-1-ethyl-5-oxo-2-thioxo-4-imidazolidinyl)acetyl]amino}benzoate
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/C22H23N3O4S/c1-3-24-20(27)18(25(22(24)30)14-15-7-5-4-6-8-15)13-19(26)23-17-11-9-16(10-12-17)21(28)29-2/h4-12,18H,3,13-14H2,1-2H3,(H,23,26)
InChIKey CZFPONVBPBSHBI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2268
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: D02344; Labnumber: MPOL-10465; SBI_ID: SBI-002270
Temperature 318 °C