Compound Identification
SMILES
COC(=O)NC(=S)NC1=C(N)C=C(SCC=C)C=C1
InChIKey
InChIKey=ZHWRGLSTJOEYQM-UHFFFAOYSA-N
Formula
C12H15N3O2S2
Mass
297.39
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
Thiophenol ethers Aniline and substituted anilines Alkylarylthioethers Methylcarbamates Thioureas Allyl sulfur compounds Sulfenyl compounds Primary amines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-phenylthiourea - Aryl thioether - Thiophenol ether - Aniline or substituted anilines - Alkylarylthioether - Methylcarbamate - Carbamic acid ester - Thiourea - Allyl sulfur compound - Sulfenyl compound - Thioether - Organic oxide - Organic oxygen compound - Amine - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - 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