Compound Identification
SMILES
COC1=CC=CC(NC(=O)NC2=CSC=C2C2=NC(=O)C(O)=C(N2)C(O)=O)=C1
InChIKey
InChIKey=CEOGHNWPSWYFGT-UHFFFAOYSA-N
Formula
C17H14N4O6S
Mass
402.38
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
Hydropyrimidine carboxylic acids and derivatives Methoxyanilines Pyrimidinecarboxylic acids Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Hydroxypyrimidines Pyrimidones Thiophenes Vinylogous amides Vinylogous acids Heteroaromatic compounds Ureas Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylurea - Hydropyrimidine carboxylic acid derivative - Pyrimidine-6-carboxylic acid - Methoxyaniline - Pyrimidine-6-carboxylic acid or derivatives - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Hydroxypyrimidine - Pyrimidone - Hydropyrimidine - Pyrimidine - Thiophene - Vinylogous amide - Vinylogous acid - Heteroaromatic compound - Urea - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Azacycle - Organic oxide - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen 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