Compound Identification
SMILES
CC1=CC=C(NC(=S)NC2=NC(=NC(=S)N2C2=CC=C(Br)C=C2)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=DAEVIZGZCWKMDD-UHFFFAOYSA-N
Formula
C23H18BrN5S2
Mass
508.46
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
Triazinethiones Toluenes Bromobenzenes Aminotriazines Aryl bromides 1,3,5-triazines Heteroaromatic compounds Thioureas Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - Amino-1,3,5-triazine - Bromobenzene - Triazinethione - Toluene - Halobenzene - Aryl bromide - Aryl halide - 1,3,5-triazine - Triazine - Heteroaromatic compound - Thiourea - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organobromide - 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