Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(C)=CC(C(=O)CSC2=NN=C(O2)C2=CC=CC=C2Br)=C1C
InChIKey
InChIKey=UIVMGSIENZADBV-UHFFFAOYSA-N
Formula
C23H20BrN3O3S
Mass
498.4
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
Methoxyanilines Phenoxy compounds Anisoles Methoxybenzenes Aryl alkyl ketones Alkyl aryl ethers Alkylarylthioethers Bromobenzenes Aryl bromides Vinylogous amides 1,3,4-oxadiazoles Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds Aldehydes Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrole - Methoxyaniline - Phenol ether - Phenoxy compound - Aryl thioether - Anisole - Aryl ketone - Aryl alkyl ketone - Methoxybenzene - Alkyl aryl ether - Halobenzene - Bromobenzene - Alkylarylthioether - Aryl halide - Aryl bromide - Benzenoid - Monocyclic benzene moiety - 1,3,4-oxadiazole - Oxadiazole - Vinylogous amide - Heteroaromatic compound - Azole - Ketone - Oxacycle - Azacycle - Sulfenyl compound - Ether - Thioether - Organopnictogen compound - Organic oxygen compound - Aldehyde - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen 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