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

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1H-pyrazole-3-acetic acid, 1-(2-benzothiazolyl)-4,5-dihydro-5-oxo-4-[1-(3-pyridinylamino)ethylidene]-, methyl ester, (4Z)-
SpectraBase Compound ID AXcO6Y4UOAV
InChI InChI=1S/C20H17N5O3S/c1-12(22-13-6-5-9-21-11-13)18-15(10-17(26)28-2)24-25(19(18)27)20-23-14-7-3-4-8-16(14)29-20/h3-9,11,22H,10H2,1-2H3/b18-12-
InChIKey NTENVWPETHUKKX-PDGQHHTCSA-N
Mol Weight 407.45 g/mol
Molecular Formula C20H17N5O3S
Exact Mass 407.105211 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 83ixdQAZb3u
Name 1H-pyrazole-3-acetic acid, 1-(2-benzothiazolyl)-4,5-dihydro-5-oxo-4-[1-(3-pyridinylamino)ethylidene]-, 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/C20H17N5O3S/c1-12(22-13-6-5-9-21-11-13)18-15(10-17(26)28-2)24-25(19(18)27)20-23-14-7-3-4-8-16(14)29-20/h3-9,11,22H,10H2,1-2H3/b18-12-
InChIKey NTENVWPETHUKKX-PDGQHHTCSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_907
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: F06818; Labnumber: VGU-77473
Temperature 308 °C