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2-(benzylthio)-3-phenyl-[1,2,4]triazolo[5,1-b]quinazolin-9-one
SpectraBase Compound ID 3hBWetSnSTn
InChI InChI=1S/C22H16N4OS/c27-20-18-13-7-8-14-19(18)23-21-25(17-11-5-2-6-12-17)22(24-26(20)21)28-15-16-9-3-1-4-10-16/h1-14H,15H2
InChIKey ZBAMYOWGTLWOMI-UHFFFAOYSA-N
Mol Weight 384.46 g/mol
Molecular Formula C22H16N4OS
Exact Mass 384.104482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IKAxoI0FxkO
Name 2-(benzylthio)-3-phenyl-[1,2,4]triazolo[5,1-b]quinazolin-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16N4OS
InChI InChI=1S/C22H16N4OS/c27-20-18-13-7-8-14-19(18)23-21-25(17-11-5-2-6-12-17)22(24-26(20)21)28-15-16-9-3-1-4-10-16/h1-14H,15H2
InChIKey ZBAMYOWGTLWOMI-UHFFFAOYSA-N
Molecular Weight 384.457 g/mol
SMILES C=12N(N=C(N2c2ccccc2)SCc2ccccc2)C(c2c(N1)cccc2)=O
SPLASH splash10-0006-9537000000-2cf89494f58df4f851f3
Source of Spectrum K1-2004-3877-15
Synonyms 2-Benzylsulfanyl-3-phenyl-[1,2,4]triazolo[5,1-b]quinazolin-9-one 3-Phenyl-2-(phenylmethylsulfanyl)-[1,2,4]triazolo[5,1-b]quinazolin-9-one 3-Phenyl-2-(phenylmethylthio)-[1,2,4]triazolo[5,1-b]quinazolin-9-one
Wiley ID 1561566