Compound Identification
SMILES
CN1C2=C(C=C(CO)S2)C=C1C1=CC=CC=C1
InChIKey
InChIKey=QQLIAWUCXWJQET-UHFFFAOYSA-N
Formula
C14H13NOS
Mass
243.32
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
Thienopyrroles 2,3,5-trisubstituted thiophenes N-methylpyrroles Benzene and substituted derivatives Heteroaromatic compounds Azoles Azacyclic compounds Primary alcohols Organonitrogen compounds Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrole - Thienopyrrole - 2,3,5-trisubstituted thiophene - Monocyclic benzene moiety - N-methylpyrrole - Benzenoid - Thiophene - Azole - Heteroaromatic compound - Azacycle - Hydrocarbon derivative - Aromatic alcohol - Organic oxygen compound - Primary alcohol - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Alcohol - 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