Compound Identification
SMILES
NC1=NC=CN1C1=CC=C(CN2CCN(CC2=O)S(=O)(=O)C2=CC3=C(C=C2)C=C(Cl)C=C3)C=C1
InChIKey
InChIKey=JDXLYAHZYNUAKI-UHFFFAOYSA-N
Formula
C24H22ClN5O3S
Mass
495.98
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
2-naphthalene sulfonic acids and derivatives
Alternative Parents
2-naphthalene sulfonamides Chloronaphthalenes Phenylimidazoles Alpha amino acids and derivatives N-alkylpiperazines Aminoimidazoles Aryl chlorides Benzene and substituted derivatives Organosulfonamides N-substituted imidazoles Heteroaromatic compounds Tertiary carboxylic acid amides Sulfonyls Lactams Azacyclic compounds Hydrocarbon derivatives Primary amines Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - Naphthalene sulfonamide - 2-naphthalene sulfonamide - Chloronaphthalene - 1-phenylimidazole - Alpha-amino acid or derivatives - N-alkylpiperazine - Aminoimidazole - Aryl chloride - Aryl halide - N-substituted imidazole - Monocyclic benzene moiety - Piperazine - 1,4-diazinane - Organosulfonic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Tertiary carboxylic acid amide - Azole - Imidazole - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Lactam - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organic nitrogen compound - Organosulfur compound - Primary amine - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-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 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available