Compound Identification
SMILES
CC(NS(=O)(=O)C1=CC=CC2=CC=CC=C12)C1=NN=C(SCC2=CC=C(F)C=C2)N1C1=CC=C(C)C=C1
InChIKey
InChIKey=NWAMWFFQIKLKCA-UHFFFAOYSA-N
Formula
C28H25FN4O2S2
Mass
532.65
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 Phenyl-1,2,4-triazoles Toluenes Fluorobenzenes Alkylarylthioethers Organosulfonamides Aryl fluorides Heteroaromatic compounds Aminosulfonyl compounds Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonic acid or derivatives - Naphthalene sulfonamide - 1-naphthalene sulfonamide - Phenyl-1,2,4-triazole - Phenyltriazole - Aryl thioether - Fluorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Organosulfonic acid amide - Azole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Triazole - 1,2,4-triazole - Aminosulfonyl compound - Azacycle - Thioether - Organoheterocyclic compound - Sulfenyl compound - Organic oxygen compound - Organosulfur compound - Organonitrogen compound - Organofluoride - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen 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