5-(1-Naphthyl)-4-(3-pyridinyl)-4H-1,2,4-triazole-3-thiol

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Systematic / IUPAC Name: 5-(1-Naphthyl)-4-(3-pyridinyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

ID: Reference4460

Other Names:

Formula: C17H12N4S

Spectral Data

5-(1-Naphthyl)-4-(3-pyridinyl)-4H-1,2,4-triazole-3-thiol 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 4/7/2016 2:26:17 PM
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Identificators

InChI InChI=1S/C17H12N4S/c22-17-20-19-16(21(17)13-7-4-10-18-11-13)15-9-3-6-12-5-1-2-8-14(12)15/h1-11H,(H,20,22)
InChI Key ZPPOEGKLXJWREK-UHFFFAOYSA-N
Canonical SMILES C1=CC=C2C(=C1)C=CC=C2C3=NNC(=S)N3C4=CN=CC=C4
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Other Names

In Other Databases

PubChem 2815835
ChEMBL CHEMBL1420092
ChemSpider 2094197