Compound Identification
SMILES
COCCN(CC1=NC(=CS1)C(=O)OC)C(=O)NC1=CC=C(C=C1)C#N
InChIKey
InChIKey=XDGHHEPEMVVEFG-UHFFFAOYSA-N
Formula
C17H18N4O4S
Mass
374.42
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
Thiazolecarboxylic acids and derivatives Benzonitriles 2,4-disubstituted thiazoles Methyl esters Heteroaromatic compounds Ureas Nitriles Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylurea - Benzonitrile - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Azole - Heteroaromatic compound - Thiazole - Methyl ester - Carboxylic acid ester - Urea - Carboxylic acid derivative - Dialkyl ether - Ether - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Cyanide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - 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