Compound Identification
SMILES
[I-].COC1=C(C)C(CS(=O)C2=NC3=CC=CC=C3N2COC(CCN2CC[N+](C)(C)CC2)OC=O)=NC=C1C
InChIKey
InChIKey=XVLQPMOMKDYHLU-UHFFFAOYSA-M
Formula
C27H38IN5O5S
Mass
671.6
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Benzimidazoles
- Subclass Sulfinylbenzimidazoles
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Class
Benzimidazoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzimidazoles
Subclass
Sulfinylbenzimidazoles
Intermediate Tree Nodes
Not available
Direct Parent
Sulfinylbenzimidazoles
Alternative Parents
Alkyl aryl ethers N-methylpiperazines Methylpyridines N-substituted imidazoles Benzenoids Tetraalkylammonium salts Heteroaromatic compounds Trialkylamines Sulfoxides Amino acids and derivatives Carboxylic acid esters Sulfinyl compounds Acetals Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic iodide salts Organic oxides Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Sulfinylbenzimidazole - Alkyl aryl ether - N-methylpiperazine - N-alkylpiperazine - Methylpyridine - Pyridine - Benzenoid - Piperazine - N-substituted imidazole - 1,4-diazinane - Azole - Imidazole - Heteroaromatic compound - Quaternary ammonium salt - Tetraalkylammonium salt - Tertiary amine - Sulfoxide - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Acetal - Carboxylic acid derivative - Ether - Azacycle - Monocarboxylic acid or derivatives - Sulfinyl compound - Organic iodide salt - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic salt - Organic zwitterion - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as sulfinylbenzimidazoles. These are polycyclic aromatic compounds containing a sulfinyl group attached at the position 2 of a benzimidazole moiety.
External Descriptors
Not available