Compound Identification
SMILES
CCNc1nc(SNC(=O)NS(=O)(=O)Cc2ccccc2C(=O)OC)nc(n1)N(CC)CC
InChIKey
InChIKey=USQUJMANPQSTKG-UHFFFAOYSA-N
Formula
C19H27N7O5S2
Mass
497.59
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
N-sulfenyl-N'-sulfonyl-ureas 1,3,5-triazine-2,4-diamines Benzoyl derivatives Dialkylarylamines N-aliphatic s-triazines 1,3,5-triazines Methyl esters Heteroaromatic compounds Aminosulfonyl compounds Organosulfonic acids and derivatives Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - N-sulfenyl-np-sulfonyl-urea - 2,4-diamine-s-triazine - Benzoyl - Dialkylarylamine - Amino-1,3,5-triazine - Aminotriazine - N-aliphatic s-triazine - Sulfonylurea - Triazine - 1,3,5-triazine - Sulfonyl - Methyl ester - Organosulfonic acid or derivatives - Aminosulfonyl compound - Heteroaromatic compound - Organic sulfonic acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Sulfenyl compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - 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