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N-(4-fluorophenyl)-N'-(5-{[(3-methylbenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2-yl)urea
SpectraBase Compound ID 74f7vPwq2Qw
InChI InChI=1S/C18H17FN4OS2/c1-12-3-2-4-13(9-12)10-25-11-16-22-23-18(26-16)21-17(24)20-15-7-5-14(19)6-8-15/h2-9H,10-11H2,1H3,(H2,20,21,23,24)
InChIKey XVNPMAYYGAEEDG-UHFFFAOYSA-N
Mol Weight 388.48 g/mol
Molecular Formula C18H17FN4OS2
Exact Mass 388.082782 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GA76q3zpL9v
Name N-(4-fluorophenyl)-N'-(5-{[(3-methylbenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2-yl)urea
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/C18H17FN4OS2/c1-12-3-2-4-13(9-12)10-25-11-16-22-23-18(26-16)21-17(24)20-15-7-5-14(19)6-8-15/h2-9H,10-11H2,1H3,(H2,20,21,23,24)
InChIKey XVNPMAYYGAEEDG-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_45
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: C28529; Labnumber: CEP3K-0777; SBI_ID: SBI-000046
Temperature 308 °C