Compound Identification
SMILES
CCCNC(=O)C1=CN2C=NN=C(NC3=C(C)C=CC(NC(=O)NCC)=C3)C2=C1C
InChIKey
InChIKey=FTXUYGLGIYTMQT-UHFFFAOYSA-N
Formula
C21H27N7O2
Mass
409.494
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
Pyrrolotriazines Diaminotoluenes Pyrrole carboxamides Aniline and substituted anilines Aminotriazines Substituted pyrroles 1,2,4-triazines Imidolactams Vinylogous amides Heteroaromatic compounds Ureas Secondary carboxylic acid amides Amino acids and derivatives Secondary amines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Pyrrolotriazine - Diaminotoluene - Pyrrole-3-carboxamide - Pyrrole-3-carboxylic acid or derivatives - Aniline or substituted anilines - Aminotriazine - Toluene - Substituted pyrrole - Triazine - Imidolactam - 1,2,4-triazine - Vinylogous amide - Pyrrole - Heteroaromatic compound - Urea - Carboxamide group - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Secondary amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Amine - 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