Compound Identification
SMILES
CC(=O)N1CCCN(CC1)C(=S)NC1=CC(C)=C(Br)C=C1
InChIKey
InChIKey=ZCUVKCPYRGMORR-UHFFFAOYSA-N
Formula
C15H20BrN3OS
Mass
370.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylthioureas
-
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
Toluenes Bromobenzenes 1,4-diazepanes Aryl bromides Tertiary carboxylic acid amides Acetamides Thioureas Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - 1,4-diazepane - Bromobenzene - Diazepane - Toluene - Halobenzene - Aryl bromide - Aryl halide - Acetamide - Tertiary carboxylic acid amide - Carboxamide group - Thiourea - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen 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