Compound Identification
SMILES
OS(=O)(=O)C1=CC=C(Cl)C=C1.CNC(=O)C1=NC=CC(COC2=NN=C(NC3=CC=C(Cl)C=C3)C3=C2OC=C3)=C1
InChIKey
InChIKey=XGMDBDDOXZCVRU-UHFFFAOYSA-N
Formula
C26H21Cl2N5O6S
Mass
602.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonic acids and derivatives
Alternative Parents
1-sulfo,2-unsubstituted aromatic compounds Pyridinecarboxamides Benzenesulfonyl compounds 2-heteroaryl carboxamides Aniline and substituted anilines Alkyl aryl ethers Aminopyridazines Chlorobenzenes Aryl chlorides Imidolactams Sulfonyls Organosulfonic acids Furans Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Oxacyclic compounds Secondary amines Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Benzenesulfonate - Arylsulfonic acid or derivatives - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - 2-heteroaryl carboxamide - Aniline or substituted anilines - Alkyl aryl ether - Aminopyridazine - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Imidolactam - Pyridazine - Pyridine - Furan - Heteroaromatic compound - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Oxacycle - Secondary amine - Ether - Hydrocarbon derivative - Amine - Organohalogen compound - Organochloride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonic acids and derivatives. These are organic compounds containing a sulfonic acid or a derivative thereof that is linked to a benzene ring.
External Descriptors
Not available