Compound Identification
SMILES
CC1=C(C)C(=CC=C1)N1C(=S)NC(=O)C(=CC2=CC=CN2C2=CC=CC(=C2)C(O)=O)C1=O
InChIKey
InChIKey=GNQPCQHGYGUYFN-UHFFFAOYSA-N
Formula
C24H19N3O4S
Mass
445.49
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
N-phenylthioureas Thiobarbituric acid derivatives Benzoic acids o-Xylenes Benzoyl derivatives Diazinanes Heteroaromatic compounds Thioureas Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrole - N-phenylthiourea - Benzoic acid or derivatives - Benzoic acid - Thiobarbiturate - O-xylene - Xylene - Benzoyl - Monocyclic benzene moiety - 1,3-diazinane - Benzenoid - Heteroaromatic compound - Thiourea - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organonitrogen compound - Organooxygen 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