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2-((5-(4-Methoxybenzoylmethylthio)-1,3,4-oxadiazol-2-yl)-methylthio)-5-dimethyl-1,2,4-triazolo-[1,5-a]pyrimidine
SpectraBase Compound ID AuYEi7De9fG
InChI InChI=1S/C18H16N6O3S2/c1-11-7-8-24-16(19-11)20-17(23-24)28-10-15-21-22-18(27-15)29-9-14(25)12-3-5-13(26-2)6-4-12/h3-8H,9-10H2,1-2H3
InChIKey DNNRXYGUWSBULV-UHFFFAOYSA-N
Mol Weight 428.49 g/mol
Molecular Formula C18H16N6O3S2
Exact Mass 428.072531 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHGazKjHSUt
Name 2-((5-(4-Methoxybenzoylmethylthio)-1,3,4-oxadiazol-2-yl)-methylthio)-5-dimethyl-1,2,4-triazolo-[1,5-a]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N6O3S2
InChI InChI=1S/C18H16N6O3S2/c1-11-7-8-24-16(19-11)20-17(23-24)28-10-15-21-22-18(27-15)29-9-14(25)12-3-5-13(26-2)6-4-12/h3-8H,9-10H2,1-2H3
InChIKey DNNRXYGUWSBULV-UHFFFAOYSA-N
Molecular Weight 428.485 g/mol
SMILES c12nc(SCc3oc(SCC(c4ccc(cc4)OC)=O)nn3)n[n]1C=CC(=N2)C
SPLASH splash10-000j-1960000000-febdcc3b3028ec8ead57
Source of Spectrum EMC-43-601-8n
Synonyms 2-((5-(4-Methoxybenzoylmethylthio)-1,3,4-oxadiazol-2-yl)-methylthio)-5-methyl-1,2,4-triazolo-[1,5-a]pyrimidine 1-(4-Methoxyphenyl)-2-((5-(((5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thio)methyl)-1,3,4-oxadiazol-2-yl)thio)ethanone 1-(4-Methoxyphenyl)-2-[[5-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
Wiley ID 1735230