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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
- Subclass Nitrogen mustard compounds
-
Class
Organonitrogen compounds
-
Superclass
Organic nitrogen compounds
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
Aniline and substituted anilines Dialkylarylamines Pyrimidones Hydropyrimidines Vinylogous amides Heteroaromatic compounds Ureas Lactams Hydrazones Azacyclic compounds Organochlorides Hydrocarbon derivatives Organooxygen compounds Organopnictogen compounds Alkyl chlorides Organic oxides
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