Compound Identification
SMILES
CCN(CCC1=CC=CC=N1)C(=O)C1=CSC(=N1)C1CCN(CC1)C(=S)NC1=CC=C(C=C1)N(C)C
InChIKey
InChIKey=LYFFEPVZSSBWAN-UHFFFAOYSA-N
Formula
C27H34N6OS2
Mass
522.73
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
Thiazolecarboxamides Dialkylarylamines Aniline and substituted anilines 2-heteroaryl carboxamides 2,4-disubstituted thiazoles Pyridines and derivatives Piperidines Tertiary carboxylic acid amides Heteroaromatic compounds Thioureas Amino acids and derivatives Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - 2-heteroaryl carboxamide - Tertiary aliphatic/aromatic amine - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - Dialkylarylamine - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Piperidine - Pyridine - Heteroaromatic compound - Azole - Thiazole - Tertiary carboxylic acid amide - Carboxamide group - Thiourea - Tertiary amine - Amino acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organic oxide - 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