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2-(5-chloro-2-thienyl)-N-(4-{[(3,4-dimethyl-5-isoxazolyl)amino]sulfonyl}phenyl)-4-quinolinecarboxamide
SpectraBase Compound ID H7Lp2Sb1ylB
InChI InChI=1S/C25H19ClN4O4S2/c1-14-15(2)29-34-25(14)30-36(32,33)17-9-7-16(8-10-17)27-24(31)19-13-21(22-11-12-23(26)35-22)28-20-6-4-3-5-18(19)20/h3-13,30H,1-2H3,(H,27,31)
InChIKey BTYWEIOIGOQBSH-UHFFFAOYSA-N
Mol Weight 539.02 g/mol
Molecular Formula C25H19ClN4O4S2
Exact Mass 538.053625 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HwNRM1KZZW3
Name 2-(5-chloro-2-thienyl)-N-(4-{[(3,4-dimethyl-5-isoxazolyl)amino]sulfonyl}phenyl)-4-quinolinecarboxamide
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/C25H19ClN4O4S2/c1-14-15(2)29-34-25(14)30-36(32,33)17-9-7-16(8-10-17)27-24(31)19-13-21(22-11-12-23(26)35-22)28-20-6-4-3-5-18(19)20/h3-13,30H,1-2H3,(H,27,31)
InChIKey BTYWEIOIGOQBSH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17558
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/9060131; UBI_ID: UBI-017561
Temperature 318 °C