Compound Identification
SMILES
COC1=CC2=C(C=C1)N=C(S2)N1C(C(=C(O)C2=CC=C(Cl)C=C2)C(=O)C1=O)C1=CC=CC=C1OC
InChIKey
InChIKey=YWAQSWVWZOQZJS-UHFFFAOYSA-N
Formula
C26H19ClN2O5S
Mass
506.96
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Benzothiazoles Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Pyrrolidine-3-ones Aryl chlorides Pyrrolidine-2-ones Tertiary carboxylic acid amides Heteroaromatic compounds Vinylogous acids Thiazoles Pyrroles Lactams Cyclic ketones Enols Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - 1,3-benzothiazole - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Heteroaromatic compound - Azole - Vinylogous acid - Thiazole - Pyrrole - Tertiary carboxylic acid amide - Cyclic ketone - Ketone - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Enol - Ether - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available