2-{[1-(2,4-Dimethylphenyl)-1H-1,2,3,4-tetraazol-5-yl]sulfanyl}-1-morpholino-1-ethanone

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Systematic / IUPAC Name: 2-{[1-(2,4-Dimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}-1-(4-morpholinyl)ethanone

ID: Reference4398

Other Names: 2-{[1-(2,4-Dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one;
2-{[1-(2,4-Dimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}-1-(morpholin-4-yl)ethanone;
Ethanone, 2-{[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]thio}-1-(4-morpholinyl)-

Formula: C15H19N5O2S

Spectral Data

2-{[1-(2,4-Dimethylphenyl)-1H-1,2,3,4-tetraazol-5-yl]sulfanyl}-1-morpholino-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 2
No. of Spectra 190
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/31/2016 1:36:10 PM
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Identificators

InChI InChI=1S/C15H19N5O2S/c1-11-3-4-13(12(2)9-11)20-15(16-17-18-20)23-10-14(21)19-5-7-22-8-6-19/h3-4,9H,5-8,10H2,1-2H3
InChI Key BVPCCYKRUIPGFV-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=C(C=C1)N2C(=NN=N2)SCC(=O)N3CCOCC3)C
CAS
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Other Names 2-{[1-(2,4-Dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one;
2-{[1-(2,4-Dimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}-1-(morpholin-4-yl)ethanone;
Ethanone, 2-{[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]thio}-1-(4-morpholinyl)-

In Other Databases

PubChem 732112
ChemSpider 639612