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acetamide, N-(3-fluoro-4-methylphenyl)-2-[[4-(2-propenyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID 3OE63DeEi88
InChI InChI=1S/C19H18FN5OS/c1-3-9-25-18(14-5-4-8-21-11-14)23-24-19(25)27-12-17(26)22-15-7-6-13(2)16(20)10-15/h3-8,10-11H,1,9,12H2,2H3,(H,22,26)
InChIKey GIMADKBJTSPXFJ-UHFFFAOYSA-N
Mol Weight 383.45 g/mol
Molecular Formula C19H18FN5OS
Exact Mass 383.12161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rP1qyuRrjE
Name 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-fluoro-4-methyl-phenyl)acetamide
Alternate Name(s) 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(3-fluoro-4-methyl-phenyl)acetamide N-(3-fluoranyl-4-methyl-phenyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide N-(3-fluoro-4-methylphenyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(3-fluoro-4-methylphenyl)-2-[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide
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Formula C19H18FN5OS
InChI InChI=1S/C19H18FN5OS/c1-3-9-25-18(14-5-4-8-21-11-14)23-24-19(25)27-12-17(26)22-15-7-6-13(2)16(20)10-15/h3-8,10-11H,1,9,12H2,2H3,(H,22,26)
InChIKey GIMADKBJTSPXFJ-UHFFFAOYSA-N
Molecular Weight 383.445 g/mol
SMILES N(C(CSc1[n](c(nn1)-c1cnccc1)CC=C)=O)c1cc(F)c(cc1)C
SPLASH splash10-0a4i-5960000000-4e37e5cf317a90e0a87c
Wiley ID 1453332