Compound Identification
SMILES
CC1=CC(NC(=S)N(CCCN2C=CN=C2)CC2=CN=CC=C2)=C(C)C=C1
InChIKey
InChIKey=JUIVMQWUKQKZBO-UHFFFAOYSA-N
Formula
C21H25N5S
Mass
379.53
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
p-Xylenes Pyridines and derivatives N-substituted imidazoles Heteroaromatic compounds Thioureas Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - P-xylene - Xylene - N-substituted imidazole - Pyridine - Azole - Imidazole - Heteroaromatic compound - Thiourea - Organoheterocyclic compound - Azacycle - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic 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