Compound Identification
SMILES
COC(=O)NC(=S)NC1=CC=CC=C1N\C=C1\C=CC(=O)C(O)=C1
InChIKey
InChIKey=XNZXMEDDFBRZLR-KTKRTIGZSA-N
Formula
C16H15N3O4S
Mass
345.37
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
P-quinomethanes Aniline and substituted anilines Secondary alkylarylamines Methylcarbamates Thioureas Enols Enamines Allylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-phenylthiourea - P-quinomethane - Quinomethane - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Methylcarbamate - Carbamic acid ester - Ketone - Cyclic ketone - Thiourea - Allylamine - Enamine - Enol - Secondary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Amine - 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