Structure Information
Structure

Compound Identification

SMILES

CCS(O)(=O)=O.CC1(C)N=C(N)N=C(N)N1C1=CC=CC(CNC(=O)NC2=CC(Cl)=CC=C2)=C1

InChIKey

InChIKey=KFCPFCJOGFREJV-UHFFFAOYSA-N

Formula

C21H28ClN7O4S

Mass

510.01

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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

Not available

Substituents

N-phenylurea - Halobenzene - Chlorobenzene - Aminotriazine - 1,3,5-triazine - Triazine - Aryl halide - Aryl chloride - Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Urea - Carbonic acid derivative - Guanidine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Imine - Carbonyl group - 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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