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

*Links on SpectraBase are not permalinks.
2-{(5Z)-5-[(1-methyl-1H-indol-3-yl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid
SpectraBase Compound ID AegFr2xmdRR
InChI InChI=1S/C22H18N2O3S2/c1-23-13-15(16-9-5-6-10-17(16)23)12-19-20(25)24(22(28)29-19)18(21(26)27)11-14-7-3-2-4-8-14/h2-10,12-13,18H,11H2,1H3,(H,26,27)/b19-12-
InChIKey DYYRUZRGBDMORD-UNOMPAQXSA-N
Mol Weight 422.52 g/mol
Molecular Formula C22H18N2O3S2
Exact Mass 422.075885 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 7GWS6Fe4JcD
Name 2-{(5Z)-5-[(1-methyl-1H-indol-3-yl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid
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/C22H18N2O3S2/c1-23-13-15(16-9-5-6-10-17(16)23)12-19-20(25)24(22(28)29-19)18(21(26)27)11-14-7-3-2-4-8-14/h2-10,12-13,18H,11H2,1H3,(H,26,27)/b19-12-
InChIKey DYYRUZRGBDMORD-UNOMPAQXSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23710
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: D43235; Labnumber: GORPS-006-4937; SBI_ID: SBI-023714
Synonyms 2-{5-[(1-methyl-1H-indol-3-yl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid
Temperature 318 °C