Compound Identification
SMILES
COC1=CC(NC(=O)NC2=CC3=C(C=C(S3)C(=O)N[C@H]3CN4CCC3CC4)C=C2)=CC(OC)=C1OC
InChIKey
InChIKey=YMPTXXROJXQCBY-IBGZPJMESA-N
Formula
C26H30N4O5S
Mass
510.61
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
1-benzothiophenes Methoxyanilines 2,3,5-trisubstituted thiophenes 2-heteroaryl carboxamides Anisoles Methoxybenzenes Phenoxy compounds Quinuclidines Thiophene carboxamides Alkyl aryl ethers Piperidines Heteroaromatic compounds Trialkylamines Amino acids and derivatives Ureas Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Methoxyaniline - Benzothiophene - 1-benzothiophene - Anisole - Quinuclidine - Methoxybenzene - Phenol ether - 2-heteroaryl carboxamide - 2,3,5-trisubstituted thiophene - Phenoxy compound - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Alkyl aryl ether - Piperidine - Heteroaromatic compound - Thiophene - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Urea - Carboxamide group - Azacycle - Carboxylic acid derivative - Ether - Organoheterocyclic compound - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen 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