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methyl (2-{(E)-[(2Z)-3-[2-(1H-indol-3-yl)ethyl]-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate
SpectraBase Compound ID Ct4tAYuG376
InChI InChI=1S/C29H25N3O4S/c1-35-27(33)19-36-25-14-8-5-9-20(25)17-26-28(34)32(29(37-26)31-22-10-3-2-4-11-22)16-15-21-18-30-24-13-7-6-12-23(21)24/h2-14,17-18,30H,15-16,19H2,1H3/b26-17+,31-29-
InChIKey CDQFYFJATCSYOT-BKMCGOQMSA-N
Mol Weight 511.6 g/mol
Molecular Formula C29H25N3O4S
Exact Mass 511.156577 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LqRMpJc7v2O
Name methyl (2-{(E)-[(2Z)-3-[2-(1H-indol-3-yl)ethyl]-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate
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/C29H25N3O4S/c1-35-27(33)19-36-25-14-8-5-9-20(25)17-26-28(34)32(29(37-26)31-22-10-3-2-4-11-22)16-15-21-18-30-24-13-7-6-12-23(21)24/h2-14,17-18,30H,15-16,19H2,1H3/b26-17+,31-29-
InChIKey CDQFYFJATCSYOT-BKMCGOQMSA-N
NMR Offset 17.5285
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14174
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: UZI/1011072; UBI_ID: UBI-014177
Synonyms methyl (2-{[3-[2-(1H-indol-3-yl)ethyl]-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate
Temperature 300 °C