Compound Identification
SMILES
CC1=CC(NC(=S)N2CCC(CC2)C(=O)NC2=CC3=C(OCO3)C=C2)=C(C)C=C1
InChIKey
InChIKey=YPESXFYTVSLIND-UHFFFAOYSA-N
Formula
C22H25N3O3S
Mass
411.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylthioureas
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylthioureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylthioureas
Alternative Parents
Piperidinecarboxamides Benzodioxoles p-Xylenes N-arylamides Thioureas Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylthiourea - Benzodioxole - Piperidinecarboxamide - P-xylene - Xylene - N-arylamide - Piperidine - Carboxamide group - Secondary carboxylic acid amide - Thiourea - Carboxylic acid derivative - Acetal - Organoheterocyclic compound - Azacycle - Oxacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylthioureas. These are compounds containing a N-phenylthiourea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a thiourea group.
External Descriptors
Not available