Compound Identification
SMILES
NC1=C(C#N)C(CC2=CC=CC=C2NC(=S)NC2=NN=C(C=C2)C2=CC=CC=C2)=NO1
InChIKey
InChIKey=KNYQQVAYPKHVMP-UHFFFAOYSA-N
Formula
C22H17N7OS
Mass
427.49
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyridazines and derivatives
- Level 5 Phenylpyridazines
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Subclass
Pyridazines and derivatives
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Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyridazines and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyridazines
Alternative Parents
N-phenylthioureas Primary aromatic amines Imidolactams Isoxazoles Heteroaromatic compounds Thioureas Oxacyclic compounds Nitriles Azacyclic compounds Organopnictogen compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyridazine - N-phenylthiourea - Monocyclic benzene moiety - Primary aromatic amine - Benzenoid - Imidolactam - Azole - Isoxazole - Heteroaromatic compound - Thiourea - Nitrile - Carbonitrile - Azacycle - Oxacycle - Hydrocarbon derivative - Cyanide - Organopnictogen compound - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyridazines. These are organic compounds containing a pyridazine ring substituted by a phenyl group.
External Descriptors
Not available