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6-benzothiazolecarboxamide, N-[4-(acetylamino)phenyl]-2-(2,5-dimethyl-1H-pyrrol-1-yl)-
SpectraBase Compound ID FCVvHzVhPVs
InChI InChI=1S/C22H20N4O2S/c1-13-4-5-14(2)26(13)22-25-19-11-6-16(12-20(19)29-22)21(28)24-18-9-7-17(8-10-18)23-15(3)27/h4-12H,1-3H3,(H,23,27)(H,24,28)
InChIKey MQBIYFIFHXGSMM-UHFFFAOYSA-N
Mol Weight 404.49 g/mol
Molecular Formula C22H20N4O2S
Exact Mass 404.130697 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7719uqaNKKZ
Name 6-benzothiazolecarboxamide, N-[4-(acetylamino)phenyl]-2-(2,5-dimethyl-1H-pyrrol-1-yl)-
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/C22H20N4O2S/c1-13-4-5-14(2)26(13)22-25-19-11-6-16(12-20(19)29-22)21(28)24-18-9-7-17(8-10-18)23-15(3)27/h4-12H,1-3H3,(H,23,27)(H,24,28)
InChIKey MQBIYFIFHXGSMM-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_9278
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: F34535; Labnumber: ExLab-211226