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4-imidazolidineacetamide, 1-(3-chloro-4-methoxyphenyl)-3-[3-[4-(4-fluorophenyl)-1-piperazinyl]propyl]-N-(4-methoxyphenyl)-5-oxo-2-thioxo-
SpectraBase Compound ID 3TXZYzmk1Cb
InChI InChI=1S/C32H35ClFN5O4S/c1-42-26-11-6-23(7-12-26)35-30(40)21-28-31(41)39(25-10-13-29(43-2)27(33)20-25)32(44)38(28)15-3-14-36-16-18-37(19-17-36)24-8-4-22(34)5-9-24/h4-13,20,28H,3,14-19,21H2,1-2H3,(H,35,40)
InChIKey XBCIQXZFQISVMN-UHFFFAOYSA-N
Mol Weight 640.2 g/mol
Molecular Formula C32H35ClFN5O4S
Exact Mass 639.208232 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KLU92S4oJrb
Name 4-imidazolidineacetamide, 1-(3-chloro-4-methoxyphenyl)-3-[3-[4-(4-fluorophenyl)-1-piperazinyl]propyl]-N-(4-methoxyphenyl)-5-oxo-2-thioxo-
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/C32H35ClFN5O4S/c1-42-26-11-6-23(7-12-26)35-30(40)21-28-31(41)39(25-10-13-29(43-2)27(33)20-25)32(44)38(28)15-3-14-36-16-18-37(19-17-36)24-8-4-22(34)5-9-24/h4-13,20,28H,3,14-19,21H2,1-2H3,(H,35,40)
InChIKey XBCIQXZFQISVMN-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_8466
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: NMR/12258852