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2-(2-methylphenyl)-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-4-quinolinecarboxamide
SpectraBase Compound ID 36rOxI5Z77y
InChI InChI=1S/C25H19N3O3S2/c1-15-7-3-4-8-17(15)22-14-19(18-9-5-6-10-20(18)26-22)24(29)28-25-27-21-12-11-16(33(2,30)31)13-23(21)32-25/h3-14H,1-2H3,(H,27,28,29)
InChIKey IKIZDBFMJCAISB-UHFFFAOYSA-N
Mol Weight 473.57 g/mol
Molecular Formula C25H19N3O3S2
Exact Mass 473.086784 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1yH2Ctk0rXz
Name 2-(2-methylphenyl)-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-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/C25H19N3O3S2/c1-15-7-3-4-8-17(15)22-14-19(18-9-5-6-10-20(18)26-22)24(29)28-25-27-21-12-11-16(33(2,30)31)13-23(21)32-25/h3-14H,1-2H3,(H,27,28,29)
InChIKey IKIZDBFMJCAISB-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10250
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/9070067; UBI_ID: UBI-010253
Temperature 313 °C