Compound Identification
SMILES
CC(C)N1CCC(CC1)C1=CNC2=C1N=C(NC(=S)NC1=C(Br)C(Br)=CC=C1)C=C2
InChIKey
InChIKey=MNGOCFBDOMLXOV-UHFFFAOYSA-N
Formula
C22H25Br2N5S
Mass
551.35
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
Pyrrolopyridines Bromobenzenes Aralkylamines Substituted pyrroles Pyridines and derivatives Piperidines Imidolactams Aryl bromides Heteroaromatic compounds Trialkylamines Thioureas Azacyclic compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylthiourea - Pyrrolopyridine - Bromobenzene - Halobenzene - Aralkylamine - Aryl bromide - Aryl halide - Piperidine - Pyridine - Substituted pyrrole - Imidolactam - Pyrrole - Heteroaromatic compound - Tertiary amine - Thiourea - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Amine - Organosulfur compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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