Compound Identification
SMILES
O=C(COC1=C(C#N)C(=CC(=N1)C1=CC=CS1)C1=CC=CO1)C1=CC=CS1
InChIKey
InChIKey=OICNUJRUTWVGLJ-UHFFFAOYSA-N
Formula
C20H12N2O3S2
Mass
392.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
- Subclass 3-pyridinecarbonitriles
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
3-pyridinecarbonitriles
Intermediate Tree Nodes
Not available
Direct Parent
3-pyridinecarbonitriles
Alternative Parents
Aryl alkyl ketones Alkyl aryl ethers Thiophenes Heteroaromatic compounds Furans Oxacyclic compounds Nitriles Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl ketone - Aryl alkyl ketone - 3-pyridinecarbonitrile - Alkyl aryl ether - Furan - Thiophene - Heteroaromatic compound - Ketone - Oxacycle - Azacycle - Nitrile - Carbonitrile - Ether - Cyanide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 3-pyridinecarbonitriles. These are organic compounds containing a pyridine ring substituted at the 3-position by a carbonitrile group.
External Descriptors
Not available