Compound Identification
SMILES
COC(=O)C1=C(C)C(=CC=C1)N1C(C)=CC(C=C2SC(=O)N(CC#C)C2=O)=C1C
InChIKey
InChIKey=UKHYJIUHMIRKHJ-UHFFFAOYSA-N
Formula
C22H20N2O4S
Mass
408.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
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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 acid esters Methoxyanilines Benzoyl derivatives Thiazolidinediones Fatty acid esters N-acyl amines Methyl esters Heteroaromatic compounds Enoate esters Dicarboximides Trialkylamines Thiocarbamic acid derivatives Organic carbonic acids and derivatives Amino acids and derivatives Sulfenyl compounds Monocarboxylic acids and derivatives Haloacetylenes and derivatives Enamines Azacyclic compounds Acetylides Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrole - Benzoate ester - Methoxyaniline - Benzoic acid or derivatives - Benzoyl - Thiazolidinedione - Fatty acid ester - Fatty acyl - Benzenoid - N-acyl-amine - Monocyclic benzene moiety - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Thiazolidine - Dicarboximide - Tertiary aliphatic amine - Thiocarbamic acid derivative - Tertiary amine - Carbonic acid derivative - Carboxylic acid ester - Amino acid or derivatives - Haloacetylene or derivatives - Acetylide - Azacycle - Sulfenyl compound - Monocarboxylic acid or derivatives - Enamine - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - 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