Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(C)=CC(C(=O)CSC2=NC=NC3=C2C=CS3)=C1C
InChIKey
InChIKey=ZYDWKGKBJHCEBI-UHFFFAOYSA-N
Formula
C21H19N3O2S2
Mass
409.52
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
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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
Thienopyrimidines Methoxyanilines Anisoles Aryl alkyl ketones Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Alkylarylthioethers Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Vinylogous amides Thiophenes Azacyclic compounds Sulfenyl compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - Thienopyrimidine - Methoxyaniline - Phenoxy compound - Aryl thioether - Anisole - Aryl ketone - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Alkyl aryl ether - Alkylarylthioether - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Thiophene - Heteroaromatic compound - Vinylogous amide - Ketone - Ether - Azacycle - Sulfenyl compound - Thioether - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - 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