Compound Identification
SMILES
CC1=C(C=CC(=C1)C1=CN=C2N1C=C(N=C2NCCC(F)(F)F)C#CCN1CCS(O)(O)CC1)C(=O)NC1CC1
InChIKey
InChIKey=VCSIAKNMOHIFQK-UHFFFAOYSA-N
Formula
C27H31F3N6O3S
Mass
576.64
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
o-Toluamides Benzamides Imidazopyrazines Benzoyl derivatives Aminopyrazines Thiomorpholines Imidolactams N-substituted imidazoles Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5-phenylimidazole - 4-phenylimidazole - Benzamide - Benzoic acid or derivatives - O-toluamide - Toluamide - Imidazopyrazine - Benzoyl - Aminopyrazine - Toluene - Imidolactam - Benzenoid - 1,4-thiazinane - Monocyclic benzene moiety - N-substituted imidazole - Pyrazine - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Amine - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic 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