Compound Identification
SMILES
CC1=C(CN(CC2=CC3=C(OCO3)C=C2)C(=O)CN(CCN2CCCC2)C(=O)NC2=CC=CC=C2C)SC=C1
InChIKey
InChIKey=ZLZOVVVNWDRIMU-UHFFFAOYSA-N
Formula
C30H36N4O4S
Mass
548.7
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
Alpha amino acids and derivatives Benzodioxoles Toluenes N-alkylpyrrolidines Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Trialkylamines Oxacyclic compounds Acetals Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - N-phenylurea - Benzodioxole - Toluene - N-alkylpyrrolidine - Pyrrolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Thiophene - Amino acid or derivatives - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Urea - Carboxylic acid derivative - Oxacycle - Azacycle - Acetal - Organoheterocyclic compound - Hydrocarbon derivative - Amine - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Aromatic heteropolycyclic 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