Compound Identification
SMILES
COC1=C(CCNC(=O)NC2=CC=CC=C2SC)C=C(Br)C=C1
InChIKey
InChIKey=KZIRSIRIUCCHKN-UHFFFAOYSA-N
Formula
C17H19BrN2O2S
Mass
395.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylureas
Alternative Parents
Thiophenol ethers Phenoxy compounds Methoxybenzenes Anisoles Bromobenzenes Alkylarylthioethers Alkyl aryl ethers Aryl bromides Ureas Sulfenyl compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-phenylurea - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Thiophenol ether - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Urea - Sulfenyl compound - Ether - Thioether - Organohalogen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
External Descriptors
Not available