Compound Identification
SMILES
CCC1=CC=CC(CC)=C1NC(=S)N\C=C(/C#N)S(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=RIXHYLJZCVGCHG-XMHGGMMESA-N
Formula
C21H23N3O2S2
Mass
413.55
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
Tosyl compounds Benzenesulfonyl compounds Sulfones Thioureas Nitriles Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-phenylthiourea - Tosyl compound - Benzenesulfonyl group - Toluene - Sulfone - Sulfonyl - Thiourea - Nitrile - Carbonitrile - Organic oxide - Cyanide - Organic oxygen compound - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic 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