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

*Links on SpectraBase are not permalinks.

ethyl 4-(4-[2-(4-fluoroanilino)-2-oxoethyl]-3-{3-[4-(4-fluorophenyl)-1-piperazinyl]propyl}-5-oxo-2-thioxo-1-imidazolidinyl)benzoate

View entire compound with spectra: 1 NMR

ethyl 4-(4-[2-(4-fluoroanilino)-2-oxoethyl]-3-{3-[4-(4-fluorophenyl)-1-piperazinyl]propyl}-5-oxo-2-thioxo-1-imidazolidinyl)benzoate
SpectraBase Compound ID IgTwK5jaSuB
InChI InChI=1S/C33H35F2N5O4S/c1-2-44-32(43)23-4-12-28(13-5-23)40-31(42)29(22-30(41)36-26-10-6-24(34)7-11-26)39(33(40)45)17-3-16-37-18-20-38(21-19-37)27-14-8-25(35)9-15-27/h4-15,29H,2-3,16-22H2,1H3,(H,36,41)
InChIKey PGTWKOJJFBGDKQ-UHFFFAOYSA-N
Mol Weight 635.7 g/mol
Molecular Formula C33H35F2N5O4S
Exact Mass 635.237782 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 ESw41VKZDTJ
Name ethyl 4-(4-[2-(4-fluoroanilino)-2-oxoethyl]-3-{3-[4-(4-fluorophenyl)-1-piperazinyl]propyl}-5-oxo-2-thioxo-1-imidazolidinyl)benzoate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 635.237782123 u
Formula C33H35F2N5O4S
InChI InChI=1S/C33H35F2N5O4S/c1-2-44-32(43)23-4-12-28(13-5-23)40-31(42)29(22-30(41)36-26-10-6-24(34)7-11-26)39(33(40)45)17-3-16-37-18-20-38(21-19-37)27-14-8-25(35)9-15-27/h4-15,29H,2-3,16-22H2,1H3,(H,36,41)
InChIKey PGTWKOJJFBGDKQ-UHFFFAOYSA-N
Molecular Weight 635.731 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8605
Solvent DMSO-d6
Source Vendor ID: NMR/13219889