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3-chloro-N-(4-{[(4-methyl-2-pyrimidinyl)amino]sulfonyl}phenyl)-1-benzothiophene-2-carboxamide
SpectraBase Compound ID 9lrjNq9yZVM
InChI InChI=1S/C20H15ClN4O3S2/c1-12-10-11-22-20(23-12)25-30(27,28)14-8-6-13(7-9-14)24-19(26)18-17(21)15-4-2-3-5-16(15)29-18/h2-11H,1H3,(H,24,26)(H,22,23,25)
InChIKey BFAPAKFYWAYDFH-UHFFFAOYSA-N
Mol Weight 458.94 g/mol
Molecular Formula C20H15ClN4O3S2
Exact Mass 458.02741 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AZxq1qRDwxs
Name 3-chloro-N-(4-{[(4-methyl-2-pyrimidinyl)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/C20H15ClN4O3S2/c1-12-10-11-22-20(23-12)25-30(27,28)14-8-6-13(7-9-14)24-19(26)18-17(21)15-4-2-3-5-16(15)29-18/h2-11H,1H3,(H,24,26)(H,22,23,25)
InChIKey BFAPAKFYWAYDFH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15860
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/8043448; UBI_ID: UBI-015863
Temperature 318 °C