Compound Identification
SMILES
COC1=CC=C(CSC(=NC)C2(CCCCC2OCCNS(=O)(=O)C2=CC=CC3=CC=CC=C23)C2=CN3C=CN=C3C=C2)C=C1
InChIKey
InChIKey=RXPYTNAVXGBJCH-UHFFFAOYSA-N
Formula
C35H38N4O4S2
Mass
642.83
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 Imidazopyridines Imidazo[1,2-a]pyridines Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Pyridines and derivatives Organosulfonamides N-substituted imidazoles Aminosulfonyl compounds Heteroaromatic compounds Imidothioesters Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Imidothioic acids and derivatives Dialkyl ethers Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - Imidazo[1,2-a]pyridine - Imidazopyridine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Organosulfonic acid amide - Pyridine - Monocyclic benzene moiety - N-substituted imidazole - Azole - Organosulfonic acid or derivatives - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Heteroaromatic compound - Imidazole - Sulfonyl - Imidothioester - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Imidothioic acid or derivatives - Organoheterocyclic compound - Azacycle - Ether - Dialkyl ether - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - 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