Structure Information
Structure

Compound Identification

SMILES

CNC1=C(F)C=C2C(=O)N(COC2=C1)C1=CC(OC)=C(NC(=O)NS(=O)(=O)C2=CC=C(Cl)S2)C(C)=C1

InChIKey

InChIKey=PHNYBHKKQRIKFV-UHFFFAOYSA-N

Formula

C22H20ClFN4O6S2

Mass

554.99

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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

Benzoxazine - N-phenylurea - Methoxyaniline - Diaminotoluene - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Sulfonylurea - Toluene - 2,5-disubstituted thiophene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Thiophene - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Lactam - Azacycle - Secondary amine - Carboxylic acid derivative - Ether - Oxacycle - Organofluoride - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - 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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