Compound Identification
SMILES
CN(C)CCC1=CNC2=C1C=CC(NS(=O)(=O)C1=CC=CC3=C1C=CC=C3Cl)=C2
InChIKey
InChIKey=UFTPDCMGWXTLSZ-UHFFFAOYSA-N
Formula
C22H22ClN3O2S
Mass
427.95
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalene sulfonic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
1-naphthalene sulfonic acids and derivatives
Alternative Parents
1-naphthalene sulfonamides Tryptamines and derivatives Chloronaphthalenes Sulfanilides 3-alkylindoles Aralkylamines Substituted pyrroles Organosulfonamides Aryl chlorides Heteroaromatic compounds Aminosulfonyl compounds Trialkylamines Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonic acid or derivatives - Naphthalene sulfonamide - 1-naphthalene sulfonamide - Tryptamine - Chloronaphthalene - Sulfanilide - 3-alkylindole - Indole - Indole or derivatives - Aralkylamine - Aryl chloride - Aryl halide - Organosulfonic acid amide - Substituted pyrrole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Heteroaromatic compound - Sulfonyl - Pyrrole - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-naphthalene sulfonic acids and derivatives. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group (or a derivative thereof) at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available