Structure Information
Structure

Compound Identification

SMILES

ClCCN(CCCl)C1=CC=C(\C=N\NC2=CNC(=O)NC2=O)C=C1

InChIKey

InChIKey=OHVCDKPZSFASGV-DJKKODMXSA-N

Formula

C15H17Cl2N5O2

Mass

370.23

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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 heteromonocyclic compounds

Substituents

Nitrogen mustard - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - Pyrimidine - Benzenoid - Vinylogous amide - Heteroaromatic compound - Urea - Tertiary amine - Lactam - Azacycle - Organoheterocyclic compound - Hydrazone - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl chloride - Organooxygen compound - Organopnictogen compound - Organic oxide - Organic oxygen compound - Alkyl halide - Amine - Aromatic heteromonocyclic 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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