Compound Identification
SMILES
CC1=CC(C)=NC(NC(NC(=S)NC2=CC=CC(C)=C2C)=NC2CC(C)(C)NC(C)(C)C2)=N1
InChIKey
InChIKey=YZVQPBPPPUWUPB-UHFFFAOYSA-N
Formula
C25H37N7S
Mass
467.68
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
o-Xylenes Pyrimidines and pyrimidine derivatives Piperidines Heteroaromatic compounds Thioureas Guanidines Propargyl-type 1,3-dipolar organic compounds Dialkylamines Carboximidamides Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - O-xylene - Xylene - Piperidine - Pyrimidine - Heteroaromatic compound - Guanidine - Thiourea - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Secondary amine - Organic 1,3-dipolar compound - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organosulfur 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