4-Methyl-5-[(5-nitro-1,3-thiazol-2-yl)thio]-4H-1,2,4-triazol-3-ol

Systematic / IUPAC Name: 4-Methyl-5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-2,4-dihydro-3H-1,2,4-triazol-3-one

ID: Reference8491

Other Names: 3H-1,2,4-Triazol-3-one, 2,4-dihydro-4-methyl-5-[(5-nitro-2-thiazolyl)thio]-

Formula: C6H5N5O3S2

Spectral Data

4-Methyl-5-[(5-nitro-1,3-thiazol-2-yl)thio]-4H-1,2,4-triazol-3-ol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 109
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/4/2019 8:40:51 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C6H5N5O3S2/c1-10-4(12)8-9-5(10)16-6-7-2-3(15-6)11(13)14/h2H,1H3,(H,8,12)
InChI Key PIUSODGZNYENTI-UHFFFAOYSA-N
Canonical SMILES CN1C(=O)NN=C1SC2=NC=C(S2)[N+](=O)[O-]
CAS
Splash
Other Names 3H-1,2,4-Triazol-3-one, 2,4-dihydro-4-methyl-5-[(5-nitro-2-thiazolyl)thio]-

In Other Databases

ChemSpider 2025194
PubChem 2743679