Compound Identification
SMILES
BrN(CC(N1CCSCC1)C(=O)NN1CCN(CC1)C1=CC=NC=C1)S(=O)(=O)C1=CC2=CC=CC=C2C(C=O)=C1
InChIKey
InChIKey=CWISAXTWBYSFCO-UHFFFAOYSA-N
Formula
C27H31BrN6O4S2
Mass
647.61
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 Pyridinylpiperazines N-arylpiperazines Alpha amino acids and derivatives Dialkylarylamines Aminopyridines and derivatives Aryl-aldehydes Thiomorpholines Organosulfonic acids and derivatives Heteroaromatic compounds Aminosulfonyl compounds Trialkylamines Carboxylic acid hydrazides Dialkylthioethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalene sulfonamide - Naphthalene sulfonamide - 2-naphthalene sulfonic acid or derivatives - Pyridinylpiperazine - N-arylpiperazine - Alpha-amino acid or derivatives - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aminopyridine - Aryl-aldehyde - 1,4-diazinane - 1,4-thiazinane - Piperazine - Pyridine - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid or derivatives - Carboxylic acid hydrazide - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Dialkylthioether - Azacycle - Carboxylic acid derivative - Thioether - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Amine - Aldehyde - Organic oxygen 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