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acetamide, N-(4-butoxyphenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

acetamide, N-(4-butoxyphenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID Dm1w5GdotG2
InChI InChI=1S/C26H25FN4O2S/c1-2-3-16-33-23-14-12-21(13-15-23)28-24(32)18-34-26-30-29-25(19-8-7-9-20(27)17-19)31(26)22-10-5-4-6-11-22/h4-15,17H,2-3,16,18H2,1H3,(H,28,32)
InChIKey GDHDESULDAHWHR-UHFFFAOYSA-N
Mol Weight 476.57 g/mol
Molecular Formula C26H25FN4O2S
Exact Mass 476.168225 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Jl556187hr
Name N-(4-butoxyphenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H25FN4O2S
InChI InChI=1S/C26H25FN4O2S/c1-2-3-16-33-23-14-12-21(13-15-23)28-24(32)18-34-26-30-29-25(19-8-7-9-20(27)17-19)31(26)22-10-5-4-6-11-22/h4-15,17H,2-3,16,18H2,1H3,(H,28,32)
InChIKey GDHDESULDAHWHR-UHFFFAOYSA-N
Molecular Weight 476.570 g/mol
SMILES N(C(CSc1[n](c(nn1)-c1cc(F)ccc1)-c1ccccc1)=O)c1ccc(cc1)OCCCC
SPLASH splash10-03di-7924000000-33d22bff11cc41d12878
Synonyms N-(4-butoxyphenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide N-(4-butoxyphenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide
Wiley ID 1459906