Compound Identification
SMILES
CCOC(=O)C1=C(OCC)C=C(C=C1)C1=C(N2C=CSC2=N1)C1=NC(N[C@@H]2CCCN(C2)S(=O)(=O)C2=CC=C(Cl)C=C2)=NC=C1
InChIKey
InChIKey=CFVHTHZLBWQQRE-JOCHJYFZSA-N
Formula
C31H31ClN6O5S2
Mass
667.2
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
Benzenesulfonamides Benzoic acid esters Benzenesulfonyl compounds Phenoxy compounds Phenol ethers Benzoyl derivatives Aminopyrimidines and derivatives Secondary alkylarylamines Chlorobenzenes Aminopiperidines Alkyl aryl ethers Organosulfonamides N-substituted imidazoles Aryl chlorides Thiazoles Heteroaromatic compounds Sulfonyls Carboxylic acid esters Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5-phenylimidazole - 4-phenylimidazole - Benzenesulfonamide - Benzoate ester - Benzenesulfonyl group - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - 3-aminopiperidine - Aminopyrimidine - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Organosulfonic acid amide - Piperidine - Pyrimidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Thiazole - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Azacycle - Carboxylic acid derivative - Ether - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organooxygen compound - Organosulfur compound - Organochloride - Amine - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - 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