N1-(4-Chlorophenyl)-2-[(5-hydroxy-4-pentyl-4H-1,2,4-triazol-3-yl)thio]acetamide

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Systematic / IUPAC Name: N-(4-Chlorophenyl)-2-[(5-oxo-4-pentyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide

ID: Reference4098

Other Names: Acetamide, N-(4-chlorophenyl)-2-[(4,5-dihydro-5-oxo-4-pentyl-1H-1,2,4-triazol-3-yl)thio]-

Formula: C15H19ClN4O2S

Spectral Data

N1-(4-Chlorophenyl)-2-[(5-hydroxy-4-pentyl-4H-1,2,4-triazol-3-yl)thio]acetamide 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 210
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/8/2016 12:27:13 PM
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Identificators

InChI InChI=1S/C15H19ClN4O2S/c1-2-3-4-9-20-14(22)18-19-15(20)23-10-13(21)17-12-7-5-11(16)6-8-12/h5-8H,2-4,9-10H2,1H3,(H,17,21)(H,18,22)
InChI Key ZBCLMZMYXKGQBR-UHFFFAOYSA-N
Canonical SMILES CCCCCN1C(=O)NN=C1SCC(=O)NC2=CC=C(C=C2)Cl
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Other Names Acetamide, N-(4-chlorophenyl)-2-[(4,5-dihydro-5-oxo-4-pentyl-1H-1,2,4-triazol-3-yl)thio]-

In Other Databases

ChemSpider 2025470
PubChem 2743967