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3,6-dichloro-N-(4-{[(5-methyl-3-isoxazolyl)amino]sulfonyl}phenyl)-1-benzothiophene-2-carboxamide
SpectraBase Compound ID F9BrPW8kmcP
InChI InChI=1S/C19H13Cl2N3O4S2/c1-10-8-16(23-28-10)24-30(26,27)13-5-3-12(4-6-13)22-19(25)18-17(21)14-7-2-11(20)9-15(14)29-18/h2-9H,1H3,(H,22,25)(H,23,24)
InChIKey LQUHTAPUNIHFNT-UHFFFAOYSA-N
Mol Weight 482.36 g/mol
Molecular Formula C19H13Cl2N3O4S2
Exact Mass 480.972454 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Dzk20rIefVb
Name 3,6-dichloro-N-(4-{[(5-methyl-3-isoxazolyl)amino]sulfonyl}phenyl)-1-benzothiophene-2-carboxamide
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/C19H13Cl2N3O4S2/c1-10-8-16(23-28-10)24-30(26,27)13-5-3-12(4-6-13)22-19(25)18-17(21)14-7-2-11(20)9-15(14)29-18/h2-9H,1H3,(H,22,25)(H,23,24)
InChIKey LQUHTAPUNIHFNT-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18867
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/9130643; UBI_ID: UBI-018870
Temperature 318 °C