4-Fluorobenzyl N-(4-methoxybenzylidene)-[(anilinocarbonyl)amino]methanehydrazonothioate

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Systematic / IUPAC Name: (4-Fluorophenyl)methyl N'-[(E)-(4-methoxyphenyl)methylideneamino]-N-(phenylcarbamoyl)carbamimidothioate

ID: Reference8550

Other Names: Hydrazinecarboximidothioic acid, 2-[(4-methoxyphenyl)methylene]-N-[(phenylamino)carbonyl]-, (4-fluorophenyl)methyl ester, (2E)-

Formula: C23H21FN4O2S

Spectral Data

4-Fluorobenzyl N-(4-methoxybenzylidene)-[(anilinocarbonyl)amino]methanehydrazonothioate 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 110
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/27/2019 12:29:11 PM
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Identificators

InChI InChI=1S/C23H21FN4O2S/c1-30-21-13-9-17(10-14-21)15-25-28-23(31-16-18-7-11-19(24)12-8-18)27-22(29)26-20-5-3-2-4-6-20/h2-15H,16H2,1H3,(H2,26,27,28,29)/b25-15+
InChI Key HRPIWMDRJKDSQV-MFKUBSTISA-N
Canonical SMILES COC1=CC=C(C=C1)C=NN=C(NC(=O)NC2=CC=CC=C2)SCC3=CC=C(C=C3)F
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Other Names Hydrazinecarboximidothioic acid, 2-[(4-methoxyphenyl)methylene]-N-[(phenylamino)carbonyl]-, (4-fluorophenyl)methyl ester, (2E)-

In Other Databases

ChemSpider 7854486
PubChem 9580338