Compound Identification
SMILES
OC(=O)C(F)(F)F.CN1C=NC(=C1SC1=NC=C(Cl)C=C1)C1=CC=C(C=C1)[C@H]1C[C@@H]1C1=NNN=N1
InChIKey
InChIKey=HIQRPBCJOZWRMI-LIOBNPLQSA-N
Formula
C21H17ClF3N7O2S
Mass
523.92
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Imidazoles
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Level 5
Substituted imidazoles
- Level 6 Phenylimidazoles
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Level 5
Substituted imidazoles
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Subclass
Imidazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles
Direct Parent
Phenylimidazoles
Alternative Parents
Diarylthioethers Pyridines and derivatives Aryl chlorides Benzene and substituted derivatives N-substituted imidazoles Tetrazoles Alpha-halocarboxylic acids Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organofluorides Organonitrogen compounds Alkyl fluorides
Molecular Framework
Not available
Substituents
5-phenylimidazole - 4-phenylimidazole - Diarylthioether - Aryl thioether - N-substituted imidazole - Monocyclic benzene moiety - Pyridine - Benzenoid - Aryl chloride - Aryl halide - Tetrazole - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Alpha-halocarboxylic acid - Thioether - Carboxylic acid - Sulfenyl compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Alkyl fluoride - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.
External Descriptors
Not available