5-(3,4-Dimethoxyphenyl)-3-[(3-thienylsulfonyl)methyl]-1,2,4-oxadiazole

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Systematic / IUPAC Name: 5-(3,4-Dimethoxyphenyl)-3-[(3-thienylsulfonyl)methyl]-1,2,4-oxadiazole

ID: Reference6376

Other Names: 5-(3,4-Dimethoxyphenyl)-3-(thiophen-3-ylsulfonylmethyl)-1,2,4-oxadiazole;
1,2,4-Oxadiazole, 5-(3,4-dimethoxyphenyl)-3-[(3-thienylsulfonyl)methyl]-

Formula: C15H14N2O5S2

Spectral Data

5-(3,4-Dimethoxyphenyl)-3-[(3-thienylsulfonyl)methyl]-1,2,4-oxadiazole 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 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/27/2017 12:08:42 PM
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Identificators

InChI InChI=1S/C15H14N2O5S2/c1-20-12-4-3-10(7-13(12)21-2)15-16-14(17-22-15)9-24(18,19)11-5-6-23-8-11/h3-8H,9H2,1-2H3
InChI Key HJTHWYXTXLOPFU-UHFFFAOYSA-N
Canonical SMILES COC1=C(C=C(C=C1)C2=NC(=NO2)CS(=O)(=O)C3=CSC=C3)OC
CAS
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Other Names 5-(3,4-Dimethoxyphenyl)-3-(thiophen-3-ylsulfonylmethyl)-1,2,4-oxadiazole;
1,2,4-Oxadiazole, 5-(3,4-dimethoxyphenyl)-3-[(3-thienylsulfonyl)methyl]-

In Other Databases

PubChem 2742615
ChemSpider 2024146