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1-((4-(((1H-benzo[d]imidazol-2-yl)thio)methyl)-1H-1,2,3-triazol-1-yl)methyl)-3H-benzo[f]chromen-3-one
SpectraBase Compound ID 5tx4i4btMcn
InChI InChI=1S/C24H17N5O2S/c30-22-11-16(23-18-6-2-1-5-15(18)9-10-21(23)31-22)12-29-13-17(27-28-29)14-32-24-25-19-7-3-4-8-20(19)26-24/h1-11,13H,12,14H2,(H,25,26)
InChIKey HIRVUVZNDILFHM-UHFFFAOYSA-N
Mol Weight 439.49 g/mol
Molecular Formula C24H17N5O2S
Exact Mass 439.110296 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C2VCWco3bpa
Name 1-((4-(((1H-benzo[d]imidazol-2-yl)thio)methyl)-1H-1,2,3-triazol-1-yl)methyl)-3H-benzo[f]chromen-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H17N5O2S
InChI InChI=1S/C24H17N5O2S/c30-22-11-16(23-18-6-2-1-5-15(18)9-10-21(23)31-22)12-29-13-17(27-28-29)14-32-24-25-19-7-3-4-8-20(19)26-24/h1-11,13H,12,14H2,(H,25,26)
InChIKey HIRVUVZNDILFHM-UHFFFAOYSA-N
Molecular Weight 439.493 g/mol
SMILES [nH]1c(nc2c1cccc2)SCc1nn[n](CC2=CC(Oc3ccc4c(c23)cccc4)=O)c1
SPLASH splash10-0udl-6910000000-a8a22b68d744003dad60
Source of Spectrum Ashish Anand, et al. Bioorganic & Medicinal Chemistry Letters, V.26, 2016, P.4709-4713
Wiley ID 1816577