Compound Identification
SMILES
CCOC(=O)C1=CC=C(C=C1)N=NC1C(C)=NN(C1=O)C1=NC(=CS1)C1=CC=C(C)C=C1
InChIKey
InChIKey=GYICOCZDAFZWFB-UHFFFAOYSA-N
Formula
C23H21N5O3S
Mass
447.51
Taxonomic Classification
Taxonomy Tree
-
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
Alpha amino acids and derivatives Benzoyl derivatives Toluenes 2,4-disubstituted thiazoles Pyrazolones Heteroaromatic compounds Carboxylic acid esters Azo compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzoate ester - Benzoyl - 2,4-disubstituted 1,3-thiazole - Toluene - Pyrazolinone - Azole - Pyrazoline - Heteroaromatic compound - Thiazole - Azo compound - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - 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