Compound Identification
SMILES
COC(=O)C1=CC(=CC=C1)N=C(S)NC1COC2C(COC12)N1C=C(COC2=CC=CC=C2)N=N1
InChIKey
InChIKey=JPKNYKSQASDFRA-UHFFFAOYSA-N
Formula
C24H25N5O5S
Mass
495.55
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
Benzoyl derivatives Phenoxy compounds Phenol ethers Furofurans Alkyl aryl ethers Triazoles Oxolanes Heteroaromatic compounds Methyl esters Isothioureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Dialkyl ethers Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Phenoxy compound - Benzoyl - Furofuran - Phenol ether - Alkyl aryl ether - Azole - Heteroaromatic compound - Oxolane - Methyl ester - 1,2,3-triazole - Carboxylic acid ester - Isothiourea - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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