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3-(4-Chlorophenyl)-2-(methylthio)-[1,2,4]triazolo[5,1-b]quinazolin-9-one
SpectraBase Compound ID 5mqfbNc59ol
InChI InChI=1S/C16H11ClN4OS/c1-23-16-19-21-14(22)12-4-2-3-5-13(12)18-15(21)20(16)11-8-6-10(17)7-9-11/h2-9H,1H3
InChIKey KXGQYWKXBRPXOQ-UHFFFAOYSA-N
Mol Weight 342.8 g/mol
Molecular Formula C16H11ClN4OS
Exact Mass 342.03421 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3n3wRtCnRvS
Name 3-(4-Chlorophenyl)-2-(methylthio)-[1,2,4]triazolo[5,1-b]quinazolin-9-one
Alternate Name(s) 3-(4-Chlorophenyl)-2-methylsulfanyl-[1,2,4]triazolo[5,1-b]quinazolin-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11ClN4OS
InChI InChI=1S/C16H11ClN4OS/c1-23-16-19-21-14(22)12-4-2-3-5-13(12)18-15(21)20(16)11-8-6-10(17)7-9-11/h2-9H,1H3
InChIKey KXGQYWKXBRPXOQ-UHFFFAOYSA-N
Molecular Weight 342.804 g/mol
SMILES C12=Nc3ccccc3C(N2N=C(N1c1ccc(cc1)Cl)SC)=O
SPLASH splash10-0036-0219000000-febb6fe6ac3e5e56260c
Source of Spectrum K1-2004-3877-15
Wiley ID 1561563