Compound Identification
SMILES
C[C@@H](CNC(=O)C1CN(CC2=CC(O)=CC=C2)C1)C1=C(NC2=C1C=C(S2)C(C)(C)C(=O)N1C2CCC1CC2)C1=CC(C)=CC(C)=C1
InChIKey
InChIKey=MLVMOAZYROFTFJ-NXGPHGMSSA-N
Formula
C38H46N4O3S
Mass
638.87
Taxonomic Classification
Taxonomy Tree
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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
m-Xylenes Thienopyrroles Phenylmethylamines 2,3,5-trisubstituted thiophenes N-acylpyrrolidines Benzylamines 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Aralkylamines Tertiary carboxylic acid amides Heteroaromatic compounds Azoles Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Azetidines Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrole - Thienopyrrole - Phenylmethylamine - 2,3,5-trisubstituted thiophene - Benzylamine - M-xylene - Xylene - N-acylpyrrolidine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Phenol - Monocyclic benzene moiety - Benzenoid - Azole - Thiophene - Tertiary carboxylic acid amide - Pyrrolidine - Heteroaromatic compound - Amino acid or derivatives - Azetidine - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic 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