Compound Identification
SMILES
OCCN(CCO)C1=NC(=NC(NC2(CC=C(\C=C\C3=CC=CC=C3S(O)(=O)=O)C(=C2)S(O)(=O)=O)NC2=NC(=NC(=N2)N(CCO)CCO)N(CCO)CCO)=N1)N(CCO)CCO
InChIKey
InChIKey=XYLWWKROFOVREZ-AATRIKPKSA-N
Formula
C36H54N12O14S2
Mass
943.02
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 Benzenesulfonyl compounds Styrenes 1,3,5-triazine-2,4-diamines Dialkylarylamines Secondary alkylarylamines N-aliphatic s-triazines 1,3,5-triazines Sulfonyls Organosulfonic acids Heteroaromatic compounds Azacyclic compounds Alkanolamines Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - 2,4-diamine-s-triazine - Styrene - Dialkylarylamine - Amino-1,3,5-triazine - Aminotriazine - Secondary aliphatic/aromatic amine - N-aliphatic s-triazine - Triazine - 1,3,5-triazine - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Tertiary amine - Alkanolamine - Secondary amine - Azacycle - Organoheterocyclic compound - Amine - Alcohol - Hydrocarbon derivative - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic 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