Compound Identification
SMILES
CCOC(=O)C1=CN(CC(O)CSC2=CC=CC=C2C(=O)NC(C)(C)C)C=C1C1=CC=CC=C1
InChIKey
InChIKey=MXBILHRKBTZICX-UHFFFAOYSA-N
Formula
C27H32N2O4S
Mass
480.62
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
O-sulfanylbenzoic acids and derivatives Benzamides Thiophenol ethers Benzoyl derivatives Pyrrole carboxylic acids and derivatives Alkylarylthioethers Vinylogous thioesters Vinylogous amides Heteroaromatic compounds Secondary carboxylic acid amides Secondary alcohols Carboxylic acid esters Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organopnictogen compounds Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-phenylpyrrole - O-sulfanylbenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Aryl thioether - Benzoyl - Pyrrole-3-carboxylic acid or derivatives - Thiophenol ether - Alkylarylthioether - Monocyclic benzene moiety - Vinylogous thioester - Benzenoid - Heteroaromatic compound - Vinylogous amide - Carboxamide group - Carboxylic acid ester - Secondary alcohol - Secondary carboxylic acid amide - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Sulfenyl compound - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Alcohol - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organic oxygen 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