Compound Identification
SMILES
COC1=C(OC)C=C(CCN(CC2=C(C)C=CS2)C(=O)CN(CCN2CCCC2)C(=O)NC2=CC(Cl)=C(F)C=C2)C=C1
InChIKey
InChIKey=HVSYDQBJFQUHTF-UHFFFAOYSA-N
Formula
C31H38ClFN4O4S
Mass
617.18
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
Alpha amino acids and derivatives Dimethoxybenzenes Phenoxy compounds Anisoles Alkyl aryl ethers Fluorobenzenes Chlorobenzenes N-alkylpyrrolidines Aryl chlorides Aryl fluorides Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Trialkylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - N-phenylurea - O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Halobenzene - Fluorobenzene - Chlorobenzene - Aryl chloride - Aryl fluoride - Aryl halide - N-alkylpyrrolidine - Pyrrolidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiophene - Tertiary amine - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Urea - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Amine - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organofluoride - Organic oxide - Organochloride - Organohalogen compound - Aromatic heteromonocyclic 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