Compound Identification
SMILES
CS(O)(=O)=O.CS(O)(=O)=O.NC(N)=NC(=O)C1=CC(N2C=CC=C2)=C(C=C1)C(=O)N=C(N)N
InChIKey
InChIKey=MBJFSAAHFCLUBR-UHFFFAOYSA-N
Formula
C16H23N7O8S2
Mass
505.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
-
Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
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Subclass
Substituted pyrroles
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Class
Pyrroles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
Benzoic acids and derivatives Benzoyl derivatives Acylguanidines Vinylogous amides Alkanesulfonic acids Sulfonyls Heteroaromatic compounds Methanesulfonates Organosulfonic acids Carboxylic acids and derivatives Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carboximidamides Hydrocarbon derivatives Organic oxides Organooxygen compounds
Molecular Framework
Not available
Substituents
1-phenylpyrrole - Benzoic acid or derivatives - Benzoyl - Acylguanidine - Monocyclic benzene moiety - Benzenoid - Methanesulfonate - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Vinylogous amide - Guanidine - Carboxylic acid derivative - Carboximidamide - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.
External Descriptors
Not available