1-(4-Bromophenyl)-2-[(5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]-1-ethanone

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Systematic / IUPAC Name: 1-(4-Bromophenyl)-2-[(5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]ethanone

ID: Reference6735

Other Names: Ethanone, 1-(4-bromophenyl)-2-[(5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)thio]-

Formula: C19H13BrN4OS

Spectral Data

1-(4-Bromophenyl)-2-[(5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]-1-ethanone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 8/16/2017 1:00:05 PM
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Identificators

InChI InChI=1S/C19H13BrN4OS/c20-15-8-6-14(7-9-15)17(25)11-26-18-10-16(13-4-2-1-3-5-13)23-19-21-12-22-24(18)19/h1-10,12H,11H2
InChI Key ZMAOGYLRNDBRTC-UHFFFAOYSA-N
Canonical SMILES C1=CC=C(C=C1)C2=NC3=NC=NN3C(=C2)SCC(=O)C4=CC=C(C=C4)Br
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Other Names Ethanone, 1-(4-bromophenyl)-2-[(5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)thio]-

In Other Databases

ChemSpider 2094324
PubChem 2815968