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3-chloro-6-methyl-N-{4-[(2-pyrimidinylamino)sulfonyl]phenyl}-1-benzothiophene-2-carboxamide
SpectraBase Compound ID Dh1rJFisrBO
InChI InChI=1S/C20H15ClN4O3S2/c1-12-3-8-15-16(11-12)29-18(17(15)21)19(26)24-13-4-6-14(7-5-13)30(27,28)25-20-22-9-2-10-23-20/h2-11H,1H3,(H,24,26)(H,22,23,25)
InChIKey YGCNNIVBUMCKKS-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 BJMeVjeK0SE
Name 3-chloro-6-methyl-N-{4-[(2-pyrimidinylamino)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/c1-12-3-8-15-16(11-12)29-18(17(15)21)19(26)24-13-4-6-14(7-5-13)30(27,28)25-20-22-9-2-10-23-20/h2-11H,1H3,(H,24,26)(H,22,23,25)
InChIKey YGCNNIVBUMCKKS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_2417
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/9401426; Labnumber: AM-AC/0211907; UZI_ID: UZI-002419
Temperature 318 °C