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2-(9-Benzyl-9H-benzo[4,5]imidazo[2,1-c][1,2,4]triazol-3-ylsulfanyl)-N-phenylacetamide
SpectraBase Compound ID EbQxC3VwxNY
InChI InChI=1S/C23H19N5OS/c29-21(24-18-11-5-2-6-12-18)16-30-23-26-25-22-27(15-17-9-3-1-4-10-17)19-13-7-8-14-20(19)28(22)23/h1-14H,15-16H2,(H,24,29)
InChIKey CMQBDRFVNVLJIO-UHFFFAOYSA-N
Mol Weight 413.5 g/mol
Molecular Formula C23H19N5OS
Exact Mass 413.131031 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QxWJ9vuUxp
Name 2-(9-Benzyl-9H-benzo[4,5]imidazo[2,1-c][1,2,4]triazol-3-ylsulfanyl)-N-phenylacetamide
Alternate Name(s) 2-[(4-benzyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)sulfanyl]-N-phenyl-acetamide 2-[(4-benzyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)thio]-N-phenyl-acetamide N-phenyl-2-[[4-(phenylmethyl)-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl]sulfanyl]ethanamide N-phenyl-2-[[4-(phenylmethyl)-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl]thio]acetamide
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Formula C23H19N5OS
InChI InChI=1S/C23H19N5OS/c29-21(24-18-11-5-2-6-12-18)16-30-23-26-25-22-27(15-17-9-3-1-4-10-17)19-13-7-8-14-20(19)28(22)23/h1-14H,15-16H2,(H,24,29)
InChIKey CMQBDRFVNVLJIO-UHFFFAOYSA-N
Molecular Weight 413.499 g/mol
SMILES N(C(CSc1nnc2N(Cc3ccccc3)c3ccccc3-[n]12)=O)c1ccccc1
SPLASH splash10-0006-9330100000-275320481e046cd86d6b
Wiley ID 1440912