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6-bromo-N-(4-{[(3,4-dimethyl-5-isoxazolyl)amino]sulfonyl}phenyl)-2-(3-ethoxyphenyl)-4-quinolinecarboxamide
SpectraBase Compound ID A8IzmbcWvhQ
InChI InChI=1S/C29H25BrN4O5S/c1-4-38-22-7-5-6-19(14-22)27-16-25(24-15-20(30)8-13-26(24)32-27)28(35)31-21-9-11-23(12-10-21)40(36,37)34-29-17(2)18(3)33-39-29/h5-16,34H,4H2,1-3H3,(H,31,35)
InChIKey UZZUCZHOASWGCV-UHFFFAOYSA-N
Mol Weight 621.51 g/mol
Molecular Formula C29H25BrN4O5S
Exact Mass 620.072904 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4EqHoV6ZtIH
Name 6-bromo-N-(4-{[(3,4-dimethyl-5-isoxazolyl)amino]sulfonyl}phenyl)-2-(3-ethoxyphenyl)-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/C29H25BrN4O5S/c1-4-38-22-7-5-6-19(14-22)27-16-25(24-15-20(30)8-13-26(24)32-27)28(35)31-21-9-11-23(12-10-21)40(36,37)34-29-17(2)18(3)33-39-29/h5-16,34H,4H2,1-3H3,(H,31,35)
InChIKey UZZUCZHOASWGCV-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_19479
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/9169885; Labnumber: U_AMK_AC/018313; UZI_ID: UZI-019486
Temperature 318 °C