Compound Identification
SMILES
C[NH+](C)CCN1C(C(C(=O)C2=C(C)N=C(C)S2)=C([O-])C1=O)C1=CC=C(OCC=C)C=C1
InChIKey
InChIKey=RWBFCMUMTYAOSJ-UHFFFAOYSA-N
Formula
C23H27N3O4S
Mass
441.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyrrolines
- Subclass Phenylpyrrolines
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Class
Pyrrolines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolines
Subclass
Phenylpyrrolines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolines
Alternative Parents
Pyrroline carboxylic acids and derivatives Phenoxy compounds Phenol ethers 2,4,5-trisubstituted thiazoles Aryl ketones Alkyl aryl ethers Vinylogous acids Tertiary carboxylic acid amides Quaternary ammonium salts Pyrroles Heteroaromatic compounds Trialkylamines Amino acids and derivatives Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - 2,4,5-trisubstituted 1,3-thiazole - Phenoxy compound - Phenol ether - Pyrroline carboxylic acid or derivatives - Aryl ketone - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Azole - Pyrrole - Heteroaromatic compound - Quaternary ammonium salt - Tertiary carboxylic acid amide - Thiazole - Vinylogous acid - Lactam - Amino acid or derivatives - Tertiary aliphatic amine - Ketone - Tertiary amine - Carboxamide group - Azacycle - Carboxylic acid derivative - Ether - Amine - Organic oxygen compound - Organic salt - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrroline ring through a CC or CN bond.
External Descriptors
Not available