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2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(5-methyl-2-furyl)ethanone

View entire compound with spectra: 1 MS (GC)

2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(5-methyl-2-furyl)ethanone
SpectraBase Compound ID DvEVbNfjawr
InChI InChI=1S/C22H19N3O3S/c1-15-8-13-20(28-15)19(26)14-29-22-24-23-21(16-9-11-18(27-2)12-10-16)25(22)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3
InChIKey ZTELCCLVBRGBHV-UHFFFAOYSA-N
Mol Weight 405.47 g/mol
Molecular Formula C22H19N3O3S
Exact Mass 405.114713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ytX2z3KlVo
Name 2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(5-methyl-2-furyl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19N3O3S
InChI InChI=1S/C22H19N3O3S/c1-15-8-13-20(28-15)19(26)14-29-22-24-23-21(16-9-11-18(27-2)12-10-16)25(22)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3
InChIKey ZTELCCLVBRGBHV-UHFFFAOYSA-N
Molecular Weight 405.472 g/mol
SMILES c1(nnc([n]1-c1ccccc1)-c1ccc(cc1)OC)SCC(=O)c1oc(cc1)C
SPLASH splash10-0m1i-9611000000-0dd3570f2fdf7564252c
Synonyms 2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(5-methylfuran-2-yl)ethanone 2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-1-(5-methyl-2-furanyl)ethanone 2-[[5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-1-(5-methyl-2-furyl)ethanone
Wiley ID 1444239