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4-((4-(((1H-benzo[d]imidazol-2-yl)thio)methyl)-1H-1,2,3-triazol-1-yl)methyl)quinolin-2(1H)-one
SpectraBase Compound ID 5liQrXkAegB
InChI InChI=1S/C20H16N6OS/c27-19-9-13(15-5-1-2-6-16(15)21-19)10-26-11-14(24-25-26)12-28-20-22-17-7-3-4-8-18(17)23-20/h1-9,11H,10,12H2,(H,21,27)(H,22,23)
InChIKey BBKIZDCNRLTUOW-UHFFFAOYSA-N
Mol Weight 388.45 g/mol
Molecular Formula C20H16N6OS
Exact Mass 388.11063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HF012yw4O5D
Name 4-((4-(((1H-benzo[d]imidazol-2-yl)thio)methyl)-1H-1,2,3-triazol-1-yl)methyl)quinolin-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16N6OS
InChI InChI=1S/C20H16N6OS/c27-19-9-13(15-5-1-2-6-16(15)21-19)10-26-11-14(24-25-26)12-28-20-22-17-7-3-4-8-18(17)23-20/h1-9,11H,10,12H2,(H,21,27)(H,22,23)
InChIKey BBKIZDCNRLTUOW-UHFFFAOYSA-N
Molecular Weight 388.449 g/mol
SMILES N1C(C=C(C[n]2nnc(CSc3nc4c(cccc4)[nH]3)c2)c2c1cccc2)=O
SPLASH splash10-0udi-9700000000-78788b84dd039af2b701
Source of Spectrum Ashish Anand, et al. Bioorganic & Medicinal Chemistry Letters, V.26, 2016, P.4709-4713
Wiley ID 1816583