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4-({(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-(trifluoromethyl)-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzenesulfonamide

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4-({(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-(trifluoromethyl)-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzenesulfonamide
SpectraBase Compound ID K2wDyCa3YX9
InChI InChI=1S/C19H14F3N5O3S2/c1-10(24-11-6-8-12(9-7-11)32(23,29)30)15-16(19(20,21)22)26-27(17(15)28)18-25-13-4-2-3-5-14(13)31-18/h2-9,24H,1H3,(H2,23,29,30)/b15-10+
InChIKey AHVVUYGOVLCLKG-XNTDXEJSSA-N
Mol Weight 481.47 g/mol
Molecular Formula C19H14F3N5O3S2
Exact Mass 481.049016 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ivupeg4AC0M
Name 4-({(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-(trifluoromethyl)-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzenesulfonamide
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/C19H14F3N5O3S2/c1-10(24-11-6-8-12(9-7-11)32(23,29)30)15-16(19(20,21)22)26-27(17(15)28)18-25-13-4-2-3-5-14(13)31-18/h2-9,24H,1H3,(H2,23,29,30)/b15-10+
InChIKey AHVVUYGOVLCLKG-XNTDXEJSSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_17956
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/8091606; Labnumber: SM-0777; UZI_ID: UZI-017963
Synonyms 4-({1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-(trifluoromethyl)-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzenesulfonamide
Temperature 315 °C