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N-(5-{2-[(4-bromophenyl)sulfonyl]ethyl}-1,3,4-thiadiazol-2-yl)-2-[(4-methylphenyl)sulfanyl]acetamide
SpectraBase Compound ID OX5sUAUtdu
InChI InChI=1S/C19H18BrN3O3S3/c1-13-2-6-15(7-3-13)27-12-17(24)21-19-23-22-18(28-19)10-11-29(25,26)16-8-4-14(20)5-9-16/h2-9H,10-12H2,1H3,(H,21,23,24)
InChIKey XLMGQCZHHASKEP-UHFFFAOYSA-N
Mol Weight 512.46 g/mol
Molecular Formula C19H18BrN3O3S3
Exact Mass 510.969368 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FrknHOuwEY9
Name N-(5-{2-[(4-bromophenyl)sulfonyl]ethyl}-1,3,4-thiadiazol-2-yl)-2-[(4-methylphenyl)sulfanyl]acetamide
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/C19H18BrN3O3S3/c1-13-2-6-15(7-3-13)27-12-17(24)21-19-23-22-18(28-19)10-11-29(25,26)16-8-4-14(20)5-9-16/h2-9H,10-12H2,1H3,(H,21,23,24)
InChIKey XLMGQCZHHASKEP-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_4519
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/8027717; Labnumber: AI-1402994; IOH_ID: IOH-004520
Temperature 303 °C