Compound Identification
SMILES
FC1=CC(Br)=C(NC(=S)N2CCOC(COC3=C(Cl)N=CC=C3)C2)C=C1
InChIKey
InChIKey=UBXMBEMKKQBTKV-UHFFFAOYSA-N
Formula
C17H16BrClFN3O2S
Mass
460.75
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
2-halopyridines Alkyl aryl ethers Bromobenzenes Fluorobenzenes Aryl bromides Aryl chlorides Aryl fluorides Morpholines Heteroaromatic compounds Thioureas Dialkyl ethers Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organobromides Organochlorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylthiourea - Alkyl aryl ether - 2-halopyridine - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl fluoride - Aryl halide - Pyridine - Oxazinane - Morpholine - Heteroaromatic compound - Thiourea - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organobromide - Organochloride - 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