N-[2-({2-[(4-Chlorophenyl)sulfonyl]ethyl}sulfanyl)phenyl]-1-methyl-1H-imidazole-4-sulfonamide

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Systematic / IUPAC Name: N-[2-({2-[(4-Chlorophenyl)sulfonyl]ethyl}sulfanyl)phenyl]-1-methyl-1H-imidazole-4-sulfonamide

ID: Reference5676

Other Names: N-[2-({2-[(4-Chlorobenzene)sulfonyl]ethyl}sulfanyl)phenyl]-1-methyl-1H-imidazole-4-sulfonamide;
1H-Imidazole-4-sulfonamide, N-[2-({2-[(4-chlorophenyl)sulfonyl]ethyl}thio)phenyl]-1-methyl-

Formula: C18H18ClN3O4S3

Spectral Data

N-[2-({2-[(4-Chlorophenyl)sulfonyl]ethyl}sulfanyl)phenyl]-1-methyl-1H-imidazole-4-sulfonamide 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 9/22/2016 8:23:06 AM
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Identificators

InChI InChI=1S/C18H18ClN3O4S3/c1-22-12-18(20-13-22)29(25,26)21-16-4-2-3-5-17(16)27-10-11-28(23,24)15-8-6-14(19)7-9-15/h2-9,12-13,21H,10-11H2,1H3
InChI Key SMRBHKBLTVJVQT-UHFFFAOYSA-N
Canonical SMILES CN1C=C(N=C1)S(=O)(=O)NC2=CC=CC=C2SCCS(=O)(=O)C3=CC=C(C=C3)Cl
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Other Names N-[2-({2-[(4-Chlorobenzene)sulfonyl]ethyl}sulfanyl)phenyl]-1-methyl-1H-imidazole-4-sulfonamide;
1H-Imidazole-4-sulfonamide, N-[2-({2-[(4-chlorophenyl)sulfonyl]ethyl}thio)phenyl]-1-methyl-

In Other Databases

PubChem 2812828
ChemSpider 2091232