Compound Identification
SMILES
[O-][N+](=O)C1=CC(Br)=C(C=C1)C1=CC=C(O1)C=C1C(=O)N(C(=S)N(C1=O)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=FXIIKCKMLGWPND-UHFFFAOYSA-N
Formula
C27H16BrN3O5S
Mass
574.41
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
Thiobarbituric acid derivatives Nitrobenzenes Nitroaromatic compounds Bromobenzenes Aryl bromides Diazinanes Heteroaromatic compounds Furans Thioureas Organic oxoazanium compounds Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids and derivatives Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Organobromides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - Nitrobenzene - Thiobarbiturate - Nitroaromatic compound - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - 1,3-diazinane - Heteroaromatic compound - Furan - Organic nitro compound - C-nitro compound - Thiourea - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organohalogen compound - Carbonyl group - Organic salt - Organic oxide - Organic oxygen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organic cation - 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