Compound Identification
SMILES
CC1CC2=C(OCC3=NC=C(C=C3)C3=CC=CC=C3)C=CC3=C2C(S1)=C(CC(C)(C)\C=N\OCC(O)=O)N3CC1=CC=C(Cl)C=C1
InChIKey
InChIKey=XLRWQDQHFVIPQK-ZXTCRCEHSA-N
Formula
C37H36ClN3O4S
Mass
654.22
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
- Subclass Phenylpyridines
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Phenylpyridines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyridines
Alternative Parents
N-alkylindoles 2-benzothiopyrans Indoles Phenol ethers Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes Thiopyrans Substituted pyrroles Aryl chlorides Heteroaromatic compounds Oxime ethers Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyridine - N-alkylindole - Indole or derivatives - Indole - 2-benzothiopyran - Benzothiopyran - Aryl thioether - Phenol ether - Alkyl aryl ether - Halobenzene - Alkylarylthioether - Chlorobenzene - Thiopyran - Aryl chloride - Substituted pyrrole - Monocyclic benzene moiety - Benzenoid - Aryl halide - Pyrrole - Heteroaromatic compound - Oxime ether - Carboxylic acid derivative - Carboxylic acid - Azacycle - Ether - Thioether - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
External Descriptors
Not available