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N-(4-chlorophenyl)-2-{[4-(2-phenylethyl)-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID CNwJvaZk31X
InChI InChI=1S/C22H19ClN4OS2/c23-17-8-10-18(11-9-17)24-20(28)15-30-22-26-25-21(19-7-4-14-29-19)27(22)13-12-16-5-2-1-3-6-16/h1-11,14H,12-13,15H2,(H,24,28)
InChIKey MWYQWXYZKAYCMN-UHFFFAOYSA-N
Mol Weight 454.99 g/mol
Molecular Formula C22H19ClN4OS2
Exact Mass 454.068881 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EIfFICj6kbU
Name N-(4-chlorophenyl)-2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
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Formula C22H19ClN4OS2
InChI InChI=1S/C22H19ClN4OS2/c23-17-8-10-18(11-9-17)24-20(28)15-30-22-26-25-21(19-7-4-14-29-19)27(22)13-12-16-5-2-1-3-6-16/h1-11,14H,12-13,15H2,(H,24,28)
InChIKey MWYQWXYZKAYCMN-UHFFFAOYSA-N
Molecular Weight 454.994 g/mol
SMILES N(C(CSc1[n](c(nn1)-c1sccc1)CCc1ccccc1)=O)c1ccc(Cl)cc1
SPLASH splash10-054k-7901000000-00da1c13fa79eaeb3282
Synonyms N-(4-chlorophenyl)-2-[[4-phenethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetamide N-(4-chlorophenyl)-2-[[4-(2-phenylethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]acetamide N-(4-chlorophenyl)-2-[[4-(2-phenylethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(4-chlorophenyl)-2-[[4-(2-phenylethyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Wiley ID 1512475