Compound Identification
SMILES
CCC1=CC(NC(=O)N(CC(C)C)CC(=O)N(CC2=CC=CS2)CC2=CC3=C(OCO3)C=C2)=CC=C1
InChIKey
InChIKey=ZGZVKUFQPDMFAO-UHFFFAOYSA-N
Formula
C28H33N3O4S
Mass
507.65
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
-
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 Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Oxacyclic compounds Acetals Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - N-phenylurea - Benzodioxole - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Urea - Carboxamide group - Oxacycle - Organoheterocyclic compound - Acetal - Carboxylic acid derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - 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