Compound Identification
SMILES
CCOC(=O)C1=CC=C(C=C1)N1C(C)=CC(C=C2C(=O)NC(=S)N(C2=O)C2=CC(C)=CC(C)=C2)=C1C
InChIKey
InChIKey=WWJHOQRFSSOSBN-UHFFFAOYSA-N
Formula
C28H27N3O4S
Mass
501.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
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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 Benzoic acid esters Thiobarbituric acid derivatives m-Xylenes Benzoyl derivatives Diazinanes Heteroaromatic compounds Thioureas Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrole - Benzoate ester - N-phenylthiourea - Benzoic acid or derivatives - Thiobarbiturate - M-xylene - Xylene - Benzoyl - Monocyclic benzene moiety - Benzenoid - 1,3-diazinane - Heteroaromatic compound - Carboxylic acid ester - Thiourea - Carboxylic acid derivative - Azacycle - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen 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