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Acetamide, 2-[[4-cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]-N-(2-ethylphenyl)-

View entire compound with spectra: 1 MS (GC)

Acetamide, 2-[[4-cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]-N-(2-ethylphenyl)-
SpectraBase Compound ID HYNU65aMBTr
InChI InChI=1S/C25H30N4O2S/c1-3-18-9-7-8-12-22(18)26-23(30)17-32-25-28-27-24(19-13-15-21(31-2)16-14-19)29(25)20-10-5-4-6-11-20/h7-9,12-16,20H,3-6,10-11,17H2,1-2H3,(H,26,30)
InChIKey YTOHZXUOFMCXOC-UHFFFAOYSA-N
Mol Weight 450.6 g/mol
Molecular Formula C25H30N4O2S
Exact Mass 450.208947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BMO3JErBltE
Name Acetamide, 2-[[4-cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]-N-(2-ethylphenyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30N4O2S
InChI InChI=1S/C25H30N4O2S/c1-3-18-9-7-8-12-22(18)26-23(30)17-32-25-28-27-24(19-13-15-21(31-2)16-14-19)29(25)20-10-5-4-6-11-20/h7-9,12-16,20H,3-6,10-11,17H2,1-2H3,(H,26,30)
InChIKey YTOHZXUOFMCXOC-UHFFFAOYSA-N
Molecular Weight 450.601 g/mol
SMILES N(C(CSc1[n](c(nn1)-c1ccc(cc1)OC)C1CCCCC1)=O)c1c(CC)cccc1
SPLASH splash10-0ac0-9860000000-7cdd9024a90f890cc543
Source of Spectrum IY-1-4485-7
Synonyms 2-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethylphenyl)acetamide 2-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethylphenyl)ethanamide
Wiley ID 1652840