N-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

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Systematic / IUPAC Name: N-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

ID: Reference4156

Other Names: Acetamide, N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio}-

Formula: C25H21N7OS

Spectral Data

N-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}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 238
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/11/2016 7:05:41 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C25H21N7OS/c1-18-16-22(32(30-18)21-10-6-3-7-11-21)27-23(33)17-34-25-29-28-24(19-12-14-26-15-13-19)31(25)20-8-4-2-5-9-20/h2-16H,17H2,1H3,(H,27,33)
InChI Key ISZDZQAOTFPPTK-UHFFFAOYSA-N
Canonical SMILES CC1=NN(C(=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4)C5=CC=CC=C5
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Other Names Acetamide, N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio}-

In Other Databases

ChemSpider 2094380
PubChem 2816024