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5-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-2-furamide
SpectraBase Compound ID JxYSwSv5W3p
InChI InChI=1S/C17H13BrN4O4S2/c1-28(24,25)12-3-4-13-15(6-12)27-17(20-13)21-16(23)14-5-2-11(26-14)9-22-8-10(18)7-19-22/h2-8H,9H2,1H3,(H,20,21,23)
InChIKey VQVAAPMMJIWOGB-UHFFFAOYSA-N
Mol Weight 481.34 g/mol
Molecular Formula C17H13BrN4O4S2
Exact Mass 479.95616 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FCy2ZrkSQXR
Name 5-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-2-furamide
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/C17H13BrN4O4S2/c1-28(24,25)12-3-4-13-15(6-12)27-17(20-13)21-16(23)14-5-2-11(26-14)9-22-8-10(18)7-19-22/h2-8H,9H2,1H3,(H,20,21,23)
InChIKey VQVAAPMMJIWOGB-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_19695
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/9147952; UBI_ID: UBI-019699
Temperature 313 °C