Compound Identification
SMILES
COC1=CC=CC=C1NC(=O)C1=C(C)N=C2SCCCN2C1C1=CC(NC(=O)NC2=CC(Cl)=C(Cl)C=C2)=CC=C1
InChIKey
InChIKey=QKEWGELTJAZDIE-UHFFFAOYSA-N
Formula
C29H27Cl2N5O3S
Mass
596.53
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
Anilides Methoxyanilines Phenoxy compounds Anisoles N-arylamides Methoxybenzenes Dichlorobenzenes Alkyl aryl ethers Thiazinanes Hydropyrimidines Aryl chlorides Ureas Secondary carboxylic acid amides Isothioureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidamides Hydrocarbon derivatives Organic oxides Amines Carbonyl compounds Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Methoxyaniline - Anilide - Phenoxy compound - Anisole - Phenol ether - N-arylamide - Methoxybenzene - 1,2-dichlorobenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - 1,6-dihydropyrimidine - Aryl halide - 1,3-thiazinane - Hydropyrimidine - Isothiourea - Urea - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic oxygen compound - Amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen 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