Compound Identification
SMILES
CCN(CC)C1=CC=C(NC(=S)N2CCCN(CC3=CC=CC(C)=N3)CC2)C=C1
InChIKey
InChIKey=ORJBZNGNAUNMFL-UHFFFAOYSA-N
Formula
C23H33N5S
Mass
411.61
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
6-substituted-2-pyridinylmethylamines Dialkylarylamines Aniline and substituted anilines Methylpyridines Aralkylamines 1,4-diazepanes Heteroaromatic compounds Trialkylamines Thioureas Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - 6-substituted-2-pyridinylmethylamine - 2-pyridylmethylamine - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - 1,4-diazepane - Methylpyridine - Diazepane - Aralkylamine - Pyridine - Heteroaromatic compound - Tertiary aliphatic amine - Thiourea - Tertiary amine - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Amine - 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