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(4E)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-({[2-(2-pyridinyl)ethyl]amino}methylene)-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID 6JhdI0HGe2G
InChI InChI=1S/C24H19N5OS/c30-23-19(16-25-15-13-18-10-6-7-14-26-18)22(17-8-2-1-3-9-17)28-29(23)24-27-20-11-4-5-12-21(20)31-24/h1-12,14,16,25H,13,15H2/b19-16+
InChIKey LJKYOFFTERVUPE-KNTRCKAVSA-N
Mol Weight 425.51 g/mol
Molecular Formula C24H19N5OS
Exact Mass 425.131031 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4efYoqOm4Hd
Name (4E)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-({[2-(2-pyridinyl)ethyl]amino}methylene)-2,4-dihydro-3H-pyrazol-3-one
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/C24H19N5OS/c30-23-19(16-25-15-13-18-10-6-7-14-26-18)22(17-8-2-1-3-9-17)28-29(23)24-27-20-11-4-5-12-21(20)31-24/h1-12,14,16,25H,13,15H2/b19-16+
InChIKey LJKYOFFTERVUPE-KNTRCKAVSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_586
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/6167622; UBI_ID: UBI-000587
Synonyms 2-(1,3-benzothiazol-2-yl)-5-phenyl-4-({[2-(2-pyridinyl)ethyl]amino}methylene)-2,4-dihydro-3H-pyrazol-3-one
Temperature 318 °C