Compound Identification
SMILES
COC1=C(NC(=O)NC2=CC=CC=C2C)C=CC(CC(=O)N2CSC[C@H]2COC2=CC=C(C=C2)C(O)=O)=C1
InChIKey
InChIKey=ZJDXNWQTMATKMQ-OAQYLSRUSA-N
Formula
C28H29N3O6S
Mass
535.62
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylureas
Alternative Parents
Phenylacetamides Benzoic acids Methoxyanilines Anisoles Benzoyl derivatives Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Toluenes Thiazolidines Tertiary carboxylic acid amides Ureas Dialkylthioethers Carboxylic acids Thiohemiaminal derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylurea - Phenylacetamide - Benzoic acid or derivatives - Benzoic acid - Methoxyaniline - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Phenol ether - Alkyl aryl ether - Toluene - Tertiary carboxylic acid amide - Thiazolidine - Urea - Carboxamide group - Thioether - Hemithioaminal - Dialkylthioether - Azacycle - Organoheterocyclic compound - Ether - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
External Descriptors
Not available