Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(\C#N)=C1\S\C(=C\NC2=CC=C(NC(=O)NCC3CCCN3CC)C=C2)C(=O)N1CC

InChIKey

InChIKey=ZMSADECRQDMMMQ-LREAIVCSSA-N

Formula

C25H32N6O4S

Mass

512.63

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

N-phenylureas

Intermediate Tree Nodes

Not available

Direct Parent

N-phenylureas

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-phenylurea - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - N-alkylpyrrolidine - Azole - Heteroaromatic compound - Pyrrolidine - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Thiazole - Lactam - Amino acid or derivatives - Tertiary amine - Urea - Tertiary aliphatic amine - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Secondary amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Amine - Cyanide - 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

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