Compound Identification
SMILES
CC1=C2C(=NC3=NC(=O)C(C#N)=C(N)C3=C2C2=CC3=C(SC4=CC=CC=C34)C=C2)N(N1)C1=CC=CC=C1
InChIKey
InChIKey=XNWOFAPVQOFBCX-UHFFFAOYSA-N
Formula
C29H18N6OS
Mass
498.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiophenes
- Subclass Dibenzothiophenes
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Class
Benzothiophenes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiophenes
Subclass
Dibenzothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
Dibenzothiophenes
Alternative Parents
Phenylpyridines Phenylpyrazoles Naphthyridines Pyrazolopyridines 1-benzothiophenes Pyridinones Aminopyridines and derivatives Benzene and substituted derivatives Vinylogous amides Thiophenes Heteroaromatic compounds Azacyclic compounds Nitriles Hydrocarbon derivatives Organic oxides Organooxygen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzothiophene - 4-phenylpyridine - Phenylpyrazole - Naphthyridine - 1-benzothiophene - Pyrazolopyridine - Aminopyridine - Pyridinone - Monocyclic benzene moiety - Benzenoid - Pyridine - Azole - Heteroaromatic compound - Vinylogous amide - Thiophene - Pyrazole - Carbonitrile - Nitrile - Azacycle - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organooxygen compound - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dibenzothiophenes. These are organic heterocyclic compounds with a structure containing a dibenzothiophene moiety, made up of two benzene rings fused to a central thiophene ring.
External Descriptors
Not available