Compound Identification
SMILES
CC1=CC=C(C=C1)S([O-])(=O)=O.CC1=CC=C(C=C1)S([O-])(=O)=O.CN1C2=[N+](C=CS2)C=C1C1=CC=C(\C=N\NC2=NC(N\N=C\C3=CC=C(C=C3)C3=C[N+]4=C(SC=C4)N3C)=NC=C2)C=C1
InChIKey
InChIKey=KGTFOENFWBNZED-YBJKMDOLSA-L
Formula
C44H40N10O6S4
Mass
933.11
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
p-Methylbenzenesulfonates Tosyl compounds 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Pyrimidines and pyrimidine derivatives N-substituted imidazoles Imidolactams Thiazoles Sulfonyls Organosulfonic acids Heteroaromatic compounds Azacyclic compounds Hydrazones Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Not available
Substituents
5-phenylimidazole - 4-phenylimidazole - P-methylbenzenesulfonate - Benzenesulfonate - Tosyl compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Toluene - Benzenoid - Imidolactam - Monocyclic benzene moiety - Pyrimidine - N-substituted imidazole - Heteroaromatic compound - Thiazole - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azacycle - Hydrazone - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organosulfur compound - Organonitrogen compound - Organic oxide - Organic cation - 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