Structure Information
Structure

Compound Identification

SMILES

CC(N1C(=O)C2=CC=CC=C2N(C)P1(=S)N(CCCl)CCCl)C1=CC=CC=C1

InChIKey

InChIKey=QEQKMCBMGNVOII-UHFFFAOYSA-N

Formula

C20H24Cl2N3OPS

Mass

456.37

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic nitrogen compounds

Class

Organonitrogen compounds

Subclass

Nitrogen mustard compounds

Intermediate Tree Nodes

Not available

Direct Parent

Nitrogen mustard compounds

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrogen mustard - Monocyclic benzene moiety - Organic thiophosphoric acid or derivatives - Benzenoid - Vinylogous amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organochloride - Organohalogen compound - Organic oxide - Alkyl chloride - Organic oxygen compound - Hydrocarbon derivative - Alkyl halide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as nitrogen mustard compounds. These are compounds having two beta-haloalkyl groups bound to a nitrogen atom.

External Descriptors

Not available

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