Compound Identification
SMILES
CCN1C(=S)NC(C2=CC=C(NC(=O)NC3=C(C=CC=C3C(C)C)C(C)C)C=C2)C(C(=O)OC)=C1C
InChIKey
InChIKey=OBVRIYASEUUMSK-UHFFFAOYSA-N
Formula
C28H36N4O3S
Mass
508.68
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
Cumenes Hydropyrimidine carboxylic acids and derivatives Phenylpropanes 2-Thiopyrimidines Pyrimidinethiones Vinylogous amides Enoate esters Methyl esters Thioureas Ureas Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylurea - Cumene - Hydropyrimidine carboxylic acid derivative - Phenylpropane - 2-thiopyrimidine - Thiopyrimidine - Pyrimidinethione - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Pyrimidine - Enoate ester - Methyl ester - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Urea - Thiourea - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur 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