2-{[2-(4-Bromophenyl)-2-oxoethyl]thio}-3-isobutyl-3,4-dihydroquinazolin-4-one

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Systematic / IUPAC Name: 2-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-3-isobutyl-4(3H)-quinazolinone

ID: Reference4819

Other Names: 2-[2-(4-Bromophenyl)-2-oxoethylthio]-3-(2-methylpropyl)-3-hydroquinazolin-4-on E;
4(3H)-Quinazolinone, 2-{[2-(4-bromophenyl)-2-oxoethyl]thio}-3-(2-methylpropyl)-

Formula: C20H19BrN2O2S

Spectral Data

2-{[2-(4-Bromophenyl)-2-oxoethyl]thio}-3-isobutyl-3,4-dihydroquinazolin-4-one 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 5/12/2016 10:25:19 AM
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Identificators

InChI InChI=1S/C20H19BrN2O2S/c1-13(2)11-23-19(25)16-5-3-4-6-17(16)22-20(23)26-12-18(24)14-7-9-15(21)10-8-14/h3-10,13H,11-12H2,1-2H3
InChI Key NPWRDRJOUYXUES-UHFFFAOYSA-N
Canonical SMILES CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=C(C=C3)Br
CAS
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Other Names 2-[2-(4-Bromophenyl)-2-oxoethylthio]-3-(2-methylpropyl)-3-hydroquinazolin-4-on E;
4(3H)-Quinazolinone, 2-{[2-(4-bromophenyl)-2-oxoethyl]thio}-3-(2-methylpropyl)-

In Other Databases

ChemSpider 850760
PubChem 981617