Compound Identification
SMILES
COC(=O)C1=C(C)NC(C)=C(C1C)C(=O)OCCCSC1=CC=C(C=C1)N1C=CN=C1
InChIKey
InChIKey=XAXXZYCINRTFQC-UHFFFAOYSA-N
Formula
C23H27N3O4S
Mass
441.55
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
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles
Direct Parent
Phenylimidazoles
Alternative Parents
Dihydropyridinecarboxylic acids and derivatives Thiophenol ethers Alkylarylthioethers Benzene and substituted derivatives Dicarboxylic acids and derivatives N-substituted imidazoles Vinylogous amides Methyl esters Enoate esters Heteroaromatic compounds Azacyclic compounds Dialkylamines Enamines Sulfenyl compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylimidazole - Dihydropyridinecarboxylic acid derivative - Aryl thioether - Thiophenol ether - Dihydropyridine - Alkylarylthioether - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Hydropyridine - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Methyl ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Sulfenyl compound - Thioether - Secondary aliphatic amine - Azacycle - Enamine - Organic nitrogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Organosulfur compound - Carbonyl group - 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