Compound Identification
SMILES
CN(C)C1=NC(NC2CCC(CC2)NC(=S)NC2=C(C)C=C(Br)C=C2C)=NC=C1
InChIKey
InChIKey=IRGVSCOCHWHICI-UHFFFAOYSA-N
Formula
C21H29BrN6S
Mass
477.47
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
m-Xylenes Dialkylarylamines Bromobenzenes Aminopyrimidines and derivatives Imidolactams Aryl bromides Heteroaromatic compounds Thioureas Azacyclic compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - M-xylene - Xylene - Dialkylarylamine - Aminopyrimidine - Bromobenzene - Halobenzene - Imidolactam - Pyrimidine - Aryl halide - Aryl bromide - Heteroaromatic compound - Thiourea - Organoheterocyclic compound - Azacycle - Organosulfur compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - 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