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2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenacyl-acetamide
SpectraBase Compound ID F3KXOUeMJ4W
InChI InChI=1S/C23H26N4O2S/c1-23(2,3)18-12-10-17(11-13-18)21-25-26-22(27(21)4)30-15-20(29)24-14-19(28)16-8-6-5-7-9-16/h5-13H,14-15H2,1-4H3,(H,24,29)
InChIKey VKMMRMWRCRROMG-UHFFFAOYSA-N
Mol Weight 422.55 g/mol
Molecular Formula C23H26N4O2S
Exact Mass 422.177647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 92h72oWKHgX
Name 2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenacyl-acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26N4O2S
InChI InChI=1S/C23H26N4O2S/c1-23(2,3)18-12-10-17(11-13-18)21-25-26-22(27(21)4)30-15-20(29)24-14-19(28)16-8-6-5-7-9-16/h5-13H,14-15H2,1-4H3,(H,24,29)
InChIKey VKMMRMWRCRROMG-UHFFFAOYSA-N
Molecular Weight 422.547 g/mol
SMILES N(C(CSc1[n](c(nn1)-c1ccc(C(C)(C)C)cc1)C)=O)CC(=O)c1ccccc1
SPLASH splash10-0arc-7951000000-d85b5f8a7627783c5313
Synonyms 2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenacyl-ethanamide 2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-phenacyl-acetamide 2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-phenacylacetamide
Wiley ID 1459426