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N-(4-ethylphenyl)-2-[[5-(2-furanyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide
SpectraBase Compound ID 4Eiaiy0BJ2w
InChI InChI=1S/C22H20N4O2S/c1-2-16-10-12-17(13-11-16)23-20(27)15-29-22-25-24-21(19-9-6-14-28-19)26(22)18-7-4-3-5-8-18/h3-14H,2,15H2,1H3,(H,23,27)
InChIKey TYWUWSJEKKNBAE-UHFFFAOYSA-N
Mol Weight 404.49 g/mol
Molecular Formula C22H20N4O2S
Exact Mass 404.130697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BpeXX7aFVWG
Name 1-PHENYL-2-(4-ETHYLPHENYLCARBAMOYLMETHYLTHIO)-5-(2-FURYL)-1,3,4-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H20N4O2S
InChI InChI=1S/C22H20N4O2S/c1-2-16-10-12-17(13-11-16)23-20(27)15-29-22-25-24-21(19-9-6-14-28-19)26(22)18-7-4-3-5-8-18/h3-14H,2,15H2,1H3,(H,23,27)
InChIKey TYWUWSJEKKNBAE-UHFFFAOYSA-N
Molecular Weight 404.1303
SMILES N(c1ccc(CC)cc1)C(=O)CSc1[n](-c2ccccc2)c(-c2occc2)nn1
SPLASH splash10-0036-9530000000-86da0dee7e3fcce3a798
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany