Structure Information
Structure

Compound Identification

SMILES

CNC1=C(F)C=C2C(OC(C)N(C2=O)C2=CC(F)=C(NC(=O)NS(=O)(=O)C3=CC=C(Cl)S3)C=C2)=C1

InChIKey

InChIKey=OGFDUZLEVWUFJJ-UHFFFAOYSA-N

Formula

C21H17ClF2N4O5S2

Mass

542.96

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxazines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzoxazines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-phenylurea - Benzoxazine - Fluorobenzene - 2,5-disubstituted thiophene - Secondary aliphatic/aromatic amine - Halobenzene - Sulfonylurea - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Thiophene - Aminosulfonyl compound - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Lactam - Oxacycle - Carboxylic acid derivative - Azacycle - Secondary amine - Organooxygen compound - Organosulfur compound - Organohalogen compound - Amine - Carbonyl group - Organochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoxazines. These are organic compounds containing a benzene fused to an oxazine ring (a six-membered aliphatic ring with four carbon atoms, one oxygen atom, and one nitrogen atom).

External Descriptors

Not available

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