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2-Benzyl-5-(3-cyanobutylamino)-1,2,4-thiadiazol-3(2H)-one
SpectraBase Compound ID GhSlPdZOhyC
InChI InChI=1S/C14H16N4OS/c1-11(9-15)7-8-16-13-17-14(19)18(20-13)10-12-5-3-2-4-6-12/h2-6,11H,7-8,10H2,1H3,(H,16,17,19)
InChIKey YFWLFRVBEPVAGK-UHFFFAOYSA-N
Mol Weight 288.37 g/mol
Molecular Formula C14H16N4OS
Exact Mass 288.104482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7EWPJAnufr3
Name 2-Benzyl-5-(3-cyanobutylamino)-1,2,4-thiadiazol-3(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N4OS
InChI InChI=1S/C14H16N4OS/c1-11(9-15)7-8-16-13-17-14(19)18(20-13)10-12-5-3-2-4-6-12/h2-6,11H,7-8,10H2,1H3,(H,16,17,19)
InChIKey YFWLFRVBEPVAGK-UHFFFAOYSA-N
Molecular Weight 288.369 g/mol
SMILES N(C1=NC(N(Cc2ccccc2)S1)=O)CCC(C#N)C
SPLASH splash10-001i-3920000000-eac60c60634f3dc541e7
Source of Spectrum F-50-7025-13
Synonyms 4-[(2-benzyl-3-oxo-2,3-dihydro-1,2,4-thiadiazol-5-yl)amino]-2-methylbutanenitrile
Wiley ID 1291480