N1-Methyl-N1-(2-methyl-4,5,6,7-tetrahydro-2H-indazol-3-yl)-2-{[5-(trifluoromethyl)-2-pyridyl]thio}acetamide

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Systematic / IUPAC Name: N-Methyl-N-(2-methyl-4,5,6,7-tetrahydro-2H-indazol-3-yl)-2-{[5-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetamide

ID: Reference4017

Other Names: Acetamide, N-methyl-N-(4,5,6,7-tetrahydro-2-methyl-2H-indazol-3-yl)-2-{[5-(trifluoromethyl)-2-pyridinyl]thio}-

Formula: C17H19F3N4OS

Spectral Data

N1-Methyl-N1-(2-methyl-4,5,6,7-tetrahydro-2H-indazol-3-yl)-2-{[5-(trifluoromethyl)-2-pyridyl]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 234
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/1/2016 9:36:49 AM
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Identificators

InChI InChI=1S/C17H19F3N4OS/c1-23(16-12-5-3-4-6-13(12)22-24(16)2)15(25)10-26-14-8-7-11(9-21-14)17(18,19)20/h7-9H,3-6,10H2,1-2H3
InChI Key IHUFTXJPCMTFSA-UHFFFAOYSA-N
Canonical SMILES CN1C(=C2CCCCC2=N1)N(C)C(=O)CSC3=NC=C(C=C3)C(F)(F)F
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Other Names Acetamide, N-methyl-N-(4,5,6,7-tetrahydro-2-methyl-2H-indazol-3-yl)-2-{[5-(trifluoromethyl)-2-pyridinyl]thio}-

In Other Databases

ChemSpider 2079967
PubChem 2801254