Compound Identification
SMILES
CCOC(=O)C1=C(NC(CC(C)C)=N1)C(C)(C)O
InChIKey
InChIKey=KPWHHIOCONHWMZ-UHFFFAOYSA-N
Formula
C13H22N2O3
Mass
254.33
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Imidazoles
-
Level 5
Substituted imidazoles
-
Level 6
Trisubstituted imidazoles
- Level 7 2,4,5-trisubstituted imidazoles
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Level 6
Trisubstituted imidazoles
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Level 5
Substituted imidazoles
-
Subclass
Imidazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles - Trisubstituted imidazoles
Direct Parent
2,4,5-trisubstituted imidazoles
Alternative Parents
Carbonylimidazoles Vinylogous amides Tertiary alcohols Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2,4,5-trisubstituted-imidazole - Imidazole-4-carbonyl group - Tertiary alcohol - Vinylogous amide - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Alcohol - Aromatic alcohol - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2,4,5-trisubstituted imidazoles. These are imidazoles in which the imidazole ring is substituted at positions 2, 4, and 5.
External Descriptors
Not available