Compound Identification
SMILES
NC1=C(C(=O)CN1C1=CC=CC=C1C#N)C1=NC2=CC=CC=C2S1
InChIKey
InChIKey=XRCBBPWQBNMWIU-UHFFFAOYSA-N
Formula
C18H12N4OS
Mass
332.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolines
- Subclass Phenylpyrrolines
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Class
Pyrrolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolines
Subclass
Phenylpyrrolines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolines
Alternative Parents
Benzothiazoles Benzonitriles Vinylogous amides Thiazoles Pyrroles Heteroaromatic compounds Tertiary amines Ketene acetals Cyclic ketones Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrroline - 1,3-benzothiazole - Benzonitrile - Monocyclic benzene moiety - Benzenoid - Azole - Pyrrole - Thiazole - Vinylogous amide - Heteroaromatic compound - Cyclic ketone - Ketene acetal or derivatives - Ketone - Tertiary amine - Nitrile - Carbonitrile - Azacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Cyanide - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrroline ring through a CC or CN bond.
External Descriptors
Not available