Compound Identification
SMILES
CC1=C(NC2=NC(NC3=C(C)C=CC(=C3)S(=O)(=O)N(CCC(N)=O)CCC(N)=O)=NC(NC3=CC(=C(C=C3)C3=C(C=C(NC4=NC(NC5=C(C)C=CC(=C5)S(=O)(=O)N(CCC(N)=O)CCC(N)=O)=NC(NC5=C(C)C=CC(=C5)S(=O)(=O)N(CCC(N)=O)CCC(N)=O)=N4)C=C3)S([O-])(=O)=O)S([O-])(=O)=O)=N2)C=C(C=C1)S(=O)(=O)N(CCC(N)=O)CCC(N)=O
InChIKey
InChIKey=BGOIWCWDGMSUTH-UHFFFAOYSA-L
Formula
C70H84N24O22S6
Mass
1805.95
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Toluenes
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Level 5
Tosyl compounds
- Level 6 P-toluenesulfonamides
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Level 5
Tosyl compounds
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Subclass
Toluenes
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Tosyl compounds - P-toluenesulfonamides
Direct Parent
N,N-disubstituted p-toluenesulfonamides
Alternative Parents
Biphenyls and derivatives Beta amino acids and derivatives Benzenesulfonic acids and derivatives Benzenesulfonamides 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Aniline and substituted anilines Aminotriazines 1,3,5-triazines Organosulfonamides Organosulfonic acids Aminosulfonyl compounds Heteroaromatic compounds Primary carboxylic acid amides Secondary amines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-disubstituted p-toluenesulfonamide - Biphenyl - Beta amino acid or derivatives - Benzenesulfonamide - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Aniline or substituted anilines - Amino-1,3,5-triazine - Aminotriazine - Organosulfonic acid amide - Triazine - 1,3,5-triazine - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Amino acid or derivatives - Primary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Secondary amine - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Amine - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic anion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n,n-disubstituted p-toluenesulfonamides. These are p-toluenesulfonamide derivatives in which the sulfonamide moiety is N,N-disubstituted.
External Descriptors
Not available