Compound Identification
SMILES
CC1=C(C=C(Cl)C=C1)N1C(CNS(=O)(=O)C2=CC=CC3=CC=CC=C23)=NN=C1SCC1=CC=C(F)C=C1
InChIKey
InChIKey=IACCHIASHAHZOL-UHFFFAOYSA-N
Formula
C27H22ClFN4O2S2
Mass
553.07
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 Alkylarylthioethers Fluorobenzenes Chlorobenzenes Organosulfonamides Aryl chlorides Aryl fluorides Aminosulfonyl compounds Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - Phenyltriazole - Phenyl-1,2,4-triazole - Aryl thioether - Chlorobenzene - Fluorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aryl fluoride - Aryl chloride - Monocyclic benzene moiety - Organosulfonic acid amide - Aryl halide - Azole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - 1,2,4-triazole - Triazole - Aminosulfonyl compound - Sulfonyl - Thioether - Organoheterocyclic compound - Sulfenyl compound - Azacycle - Organic oxide - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organic nitrogen compound - 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