Compound Identification
SMILES
CNC1=C(SC(=C1)C1=CC(Cl)=CC=C1)C#N
InChIKey
InChIKey=CBJRRLYHRYBWGM-UHFFFAOYSA-N
Formula
C12H9ClN2S
Mass
248.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiophenes
- Subclass 2,3,5-trisubstituted thiophenes
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Class
Thiophenes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
2,3,5-trisubstituted thiophenes
Intermediate Tree Nodes
Not available
Direct Parent
2,3,5-trisubstituted thiophenes
Alternative Parents
Secondary alkylarylamines Chlorobenzenes Aryl chlorides Aminothiophenes Heteroaromatic compounds Nitriles Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2,3,5-trisubstituted thiophene - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aminothiophene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Nitrile - Carbonitrile - Secondary amine - Organochloride - Organohalogen compound - Cyanide - Organic nitrogen compound - Amine - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2,3,5-trisubstituted thiophenes. These are organic compounds containing a thiophene that is trisubstituted at the C-2, C3- and C5-positions.
External Descriptors
Not available