Compound Identification
SMILES
CCCCN1C(SC(C1=O)=C1SC2=C(C=C(OC)C=C2)N1CC)=NC1=CC=C(C=C1)C(=O)OC
InChIKey
InChIKey=XIJVEUOMJIGAOP-UHFFFAOYSA-N
Formula
C25H27N3O4S2
Mass
497.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Benzothiazoles Anisoles Aryl thioethers Benzoyl derivatives Alkyl aryl ethers Vinylogous thioesters Vinylogous amides Thiazolidines Thiazoles Methyl esters Isothioureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Amines Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Anisole - Benzoyl - Phenol ether - Alkyl aryl ether - Vinylogous thioester - Vinylogous amide - Thiazole - Thiazolidine - Methyl ester - Isothiourea - Carboxylic acid ester - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Aromatic heteropolycyclic 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