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2-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)acetamide

View entire compound with spectra: 1 MS (GC)

2-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)acetamide
SpectraBase Compound ID HBIQLG2qLKD
InChI InChI=1S/C25H24N4O2S/c1-18(19-10-5-3-6-11-19)26-23(30)17-32-25-28-27-24(20-12-9-15-22(16-20)31-2)29(25)21-13-7-4-8-14-21/h3-16,18H,17H2,1-2H3,(H,26,30)
InChIKey CCUMBMVWYPLWRI-UHFFFAOYSA-N
Mol Weight 444.55 g/mol
Molecular Formula C25H24N4O2S
Exact Mass 444.161997 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Kfrl9ZMQ4
Name 2-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)acetamide
Alternate Name(s) 2-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)ethanamide 2-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(1-phenylethyl)acetamide
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Formula C25H24N4O2S
InChI InChI=1S/C25H24N4O2S/c1-18(19-10-5-3-6-11-19)26-23(30)17-32-25-28-27-24(20-12-9-15-22(16-20)31-2)29(25)21-13-7-4-8-14-21/h3-16,18H,17H2,1-2H3,(H,26,30)
InChIKey CCUMBMVWYPLWRI-UHFFFAOYSA-N
Molecular Weight 444.553 g/mol
SMILES N(C(CSc1[n](c(nn1)-c1cc(OC)ccc1)-c1ccccc1)=O)C(c1ccccc1)C
SPLASH splash10-001l-8980000000-27b350199be776de9448
Wiley ID 1461080