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2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-tert-butyl-acetamide
SpectraBase Compound ID AtcmNZUhsV8
InChI InChI=1S/C16H22N4OS/c1-16(2,3)17-14(21)11-22-15-19-18-13(20(15)4)10-12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3,(H,17,21)
InChIKey DCZRUIINCCXBQS-UHFFFAOYSA-N
Mol Weight 318.44 g/mol
Molecular Formula C16H22N4OS
Exact Mass 318.151433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AOZaWBHV4fg
Name 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-tert-butyl-acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N4OS
InChI InChI=1S/C16H22N4OS/c1-16(2,3)17-14(21)11-22-15-19-18-13(20(15)4)10-12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3,(H,17,21)
InChIKey DCZRUIINCCXBQS-UHFFFAOYSA-N
Molecular Weight 318.439 g/mol
SMILES N(C(=O)CSc1nnc([n]1C)Cc1ccccc1)C(C)(C)C
SPLASH splash10-00kf-9360000000-815746896480c743f816
Source of Spectrum AD-0-2532-0
Synonyms 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-tert-butyl-acetamide Acetamide, 2-(5-benzyl-4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-(tert-butyl)- N-tert-butyl-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide N-tert-butyl-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide
Wiley ID 1436216