Compound Identification
SMILES
COC(=O)C1=CC=C(CNCC2=CN=C(NC(=O)N(C3CCCCC3)C3CCCCC3)S2)C=C1
InChIKey
InChIKey=SPPJXDILRXTHFL-UHFFFAOYSA-N
Formula
C26H36N4O3S
Mass
484.66
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Phenylmethylamines Benzylamines Benzoyl derivatives Aralkylamines 2,5-disubstituted thiazoles Methyl esters Heteroaromatic compounds Ureas Tertiary amines Amino acids and derivatives Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Benzoyl - Benzylamine - Phenylmethylamine - Aralkylamine - 2,5-disubstituted 1,3-thiazole - Heteroaromatic compound - Azole - Methyl ester - Thiazole - Carboxylic acid ester - Amino acid or derivatives - Tertiary amine - Urea - Secondary aliphatic amine - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Secondary amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available