Compound Identification
SMILES
CN(C1CCCC1)C(=O)[C@H](CC#CC1=CC(N)=C(N)C=C1)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1
InChIKey
InChIKey=IQPNICBDXUHUJG-SANMLTNESA-N
Formula
C27H30N4O3S
Mass
490.62
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 Alpha amino acid amides Aniline and substituted anilines Organosulfonamides N-acyl amines Tertiary carboxylic acid amides Aminosulfonyl compounds Tertiary amines Primary amines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - Naphthalene sulfonamide - 2-naphthalene sulfonamide - Alpha-amino acid amide - Alpha-amino acid or derivatives - Aniline or substituted anilines - Monocyclic benzene moiety - N-acyl-amine - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Sulfonyl - Tertiary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Tertiary amine - Carboxylic acid derivative - Organic nitrogen compound - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Amine - Aromatic homopolycyclic 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