Compound Identification
SMILES
ClC1=CC=CC2=C1C(SCC(=O)N1CCCN(CC3=CC=CO3)CC1)=CC=C2
InChIKey
InChIKey=MMLXFCQBEVJMAP-UHFFFAOYSA-N
Formula
C22H23ClN2O2S
Mass
414.95
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
- Subclass Chloronaphthalenes
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Chloronaphthalenes
Intermediate Tree Nodes
Not available
Direct Parent
Chloronaphthalenes
Alternative Parents
Thiophenol ethers 1,4-diazepanes Alkylarylthioethers Aralkylamines Aryl chlorides Tertiary carboxylic acid amides Furans Heteroaromatic compounds Amino acids and derivatives Trialkylamines Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chloronaphthalene - Aryl thioether - Thiophenol ether - 1,4-diazepane - Diazepane - Aralkylamine - Alkylarylthioether - Aryl chloride - Aryl halide - Heteroaromatic compound - Furan - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organohalogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as chloronaphthalenes. These are aromatic heterocyclic compounds containing a naphthalene moiety substituted at one or more positions by a chlorine atom.
External Descriptors
Not available