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1H-pyrazole-3-acetic acid, 1-(2-benzothiazolyl)-4,5-dihydro-4-[1-[[2-(1H-indol-3-yl)ethyl]amino]ethylidene]-5-oxo-, methyl ester, (4Z)-

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1H-pyrazole-3-acetic acid, 1-(2-benzothiazolyl)-4,5-dihydro-4-[1-[[2-(1H-indol-3-yl)ethyl]amino]ethylidene]-5-oxo-, methyl ester, (4Z)-
SpectraBase Compound ID FLzBkIHeTqw
InChI InChI=1S/C25H23N5O3S/c1-15(26-12-11-16-14-27-18-8-4-3-7-17(16)18)23-20(13-22(31)33-2)29-30(24(23)32)25-28-19-9-5-6-10-21(19)34-25/h3-10,14,26-27H,11-13H2,1-2H3/b23-15-
InChIKey QUUGFZQSNHQLPA-HAHDFKILSA-N
Mol Weight 473.55 g/mol
Molecular Formula C25H23N5O3S
Exact Mass 473.152161 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID lYmPvQITVx
Name 1H-pyrazole-3-acetic acid, 1-(2-benzothiazolyl)-4,5-dihydro-4-[1-[[2-(1H-indol-3-yl)ethyl]amino]ethylidene]-5-oxo-, methyl ester, (4Z)-
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/C25H23N5O3S/c1-15(26-12-11-16-14-27-18-8-4-3-7-17(16)18)23-20(13-22(31)33-2)29-30(24(23)32)25-28-19-9-5-6-10-21(19)34-25/h3-10,14,26-27H,11-13H2,1-2H3/b23-15-
InChIKey QUUGFZQSNHQLPA-HAHDFKILSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_922
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: F06834; Labnumber: VGU-77663
Temperature 308 °C