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acetamide, N-(4-bromophenyl)-2-[[5-[[(4-chlorophenyl)amino]methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID IqnJ3jyrgaP
InChI InChI=1S/C24H21BrClN5OS/c1-16-4-2-3-5-21(16)31-22(14-27-19-12-8-18(26)9-13-19)29-30-24(31)33-15-23(32)28-20-10-6-17(25)7-11-20/h2-13,27H,14-15H2,1H3,(H,28,32)
InChIKey DSJNCDPIGPUISY-UHFFFAOYSA-N
Mol Weight 542.88 g/mol
Molecular Formula C24H21BrClN5OS
Exact Mass 541.033872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7SyPGl48ph0
Name N-(4-bromophenyl)-2-[[5-[(4-chloroanilino)methyl]-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Alternate Name(s) N-(4-bromophenyl)-2-[[5-[(4-chloroanilino)methyl]-4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]acetamide N-(4-bromophenyl)-2-[[5-[(4-chloroanilino)methyl]-4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(4-bromophenyl)-2-[[5-[(4-chloroanilino)methyl]-4-(o-tolyl)-1,2,4-triazol-3-yl]thio]acetamide N-(4-bromophenyl)-2-[[5-[[(4-chlorophenyl)amino]methyl]-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide
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Formula C24H21BrClN5OS
InChI InChI=1S/C24H21BrClN5OS/c1-16-4-2-3-5-21(16)31-22(14-27-19-12-8-18(26)9-13-19)29-30-24(31)33-15-23(32)28-20-10-6-17(25)7-11-20/h2-13,27H,14-15H2,1H3,(H,28,32)
InChIKey DSJNCDPIGPUISY-UHFFFAOYSA-N
Molecular Weight 542.883 g/mol
SMILES N(Cc1[n](c(SCC(Nc2ccc(cc2)Br)=O)nn1)-c1c(C)cccc1)c1ccc(cc1)Cl
SPLASH splash10-052f-1921000000-365c855bd44a8e7eb490
Wiley ID 1464606