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N-(5-{2-[(3,4-dimethylphenyl)sulfonyl]ethyl}-1,3,4-thiadiazol-2-yl)-4-methylbenzamide
SpectraBase Compound ID peeJ6ISNB7
InChI InChI=1S/C20H21N3O3S2/c1-13-4-7-16(8-5-13)19(24)21-20-23-22-18(27-20)10-11-28(25,26)17-9-6-14(2)15(3)12-17/h4-9,12H,10-11H2,1-3H3,(H,21,23,24)
InChIKey YNQGWWSHMUAIQR-UHFFFAOYSA-N
Mol Weight 415.53 g/mol
Molecular Formula C20H21N3O3S2
Exact Mass 415.102434 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID R3ZZW65ayb
Name N-(5-{2-[(3,4-dimethylphenyl)sulfonyl]ethyl}-1,3,4-thiadiazol-2-yl)-4-methylbenzamide
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/C20H21N3O3S2/c1-13-4-7-16(8-5-13)19(24)21-20-23-22-18(27-20)10-11-28(25,26)17-9-6-14(2)15(3)12-17/h4-9,12H,10-11H2,1-3H3,(H,21,23,24)
InChIKey YNQGWWSHMUAIQR-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_691
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: ZI/8167121; Labnumber: AI-1411577
Temperature 303 °C