Compound Identification
SMILES
CCOC(=O)C(\C#N)=C1\S\C(=C\NC2=CC(NC(=O)N3CCN(CCO)CC3)=C(F)C=C2)C(=O)N1CC
InChIKey
InChIKey=GTICTMIUWRRGLU-PPWXJTFYSA-N
Formula
C24H29FN6O5S
Mass
532.59
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
Piperazine carboxamides Aniline and substituted anilines Secondary alkylarylamines N-alkylpiperazines Fluorobenzenes Aryl fluorides Vinylogous amides Thiazoles Enoate esters Heteroaromatic compounds Ureas Trialkylamines 1,2-aminoalcohols Amino acids and derivatives Lactams Nitriles Azacyclic compounds Monocarboxylic acids and derivatives Organofluorides Primary alcohols Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylurea - Piperazine-1-carboxamide - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - N-alkylpiperazine - Halobenzene - Fluorobenzene - Aryl halide - Piperazine - Aryl fluoride - 1,4-diazinane - Azole - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Thiazole - Heteroaromatic compound - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid ester - Lactam - Urea - Tertiary aliphatic amine - Tertiary amine - Secondary amine - Carboxylic acid derivative - Alkanolamine - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic oxide - Primary alcohol - Organic nitrogen compound - Carbonyl group - Cyanide - Amine - Alcohol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organohalogen compound - Organofluoride - 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