4-(4-Chlorobenzylidene)-1-[2-(1H-indol-3-yl)ethyl]-2-(methylthio)-4,5-dihydro-1H-imidazol-5-one

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Systematic / IUPAC Name: (5Z)-5-(4-Chlorobenzylidene)-3-[2-(1H-indol-3-yl)ethyl]-2-(methylsulfanyl)-3,5-dihydro-4H-imidazol-4-one

ID: Reference3839

Other Names: 4H-Imidazol-4-one, 5-[(4-chlorophenyl)methylene]-3,5-dihydro-3-[2-(1H-indol-3-yl)ethyl]-2-(methylthio)-, (5Z)-

Formula: C21H18ClN3OS

Spectral Data

4-(4-Chlorobenzylidene)-1-[2-(1H-indol-3-yl)ethyl]-2-(methylthio)-4,5-dihydro-1H-imidazol-5-one 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 2/15/2016 10:16:09 AM
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Identificators

InChI InChI=1S/C21H18ClN3OS/c1-27-21-24-19(12-14-6-8-16(22)9-7-14)20(26)25(21)11-10-15-13-23-18-5-3-2-4-17(15)18/h2-9,12-13,23H,10-11H2,1H3/b19-12-
InChI Key YVCYCTOJZJHTEZ-UNOMPAQXSA-N
Canonical SMILES CSC1=NC(=CC2=CC=C(C=C2)Cl)C(=O)N1CCC3=CNC4=CC=CC=C43
CAS
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Other Names 4H-Imidazol-4-one, 5-[(4-chlorophenyl)methylene]-3,5-dihydro-3-[2-(1H-indol-3-yl)ethyl]-2-(methylthio)-, (5Z)-

In Other Databases

ChemSpider 4757310
PubChem 5939679