Compound Identification
SMILES
CN(C)C1=CC=C(C=C1)C1N(C2=NN=C(SCC3=CC=CC4=CC=CC=C34)S2)C(=O)C(O)=C1C(=O)C1=C(C)N=C(C)S1
InChIKey
InChIKey=KFWJYQWTUGRGCB-UHFFFAOYSA-N
Formula
C31H27N5O3S3
Mass
613.77
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Naphthalenes 2,4,5-trisubstituted thiazoles Aniline and substituted anilines Aryl ketones Pyrroline carboxylic acids and derivatives Dialkylarylamines Alkylarylthioethers Vinylogous acids Thiadiazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Amino acids and derivatives Lactams Azacyclic compounds Enols Sulfenyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Naphthalene - 2,4,5-trisubstituted 1,3-thiazole - Aryl thioether - Pyrroline carboxylic acid or derivatives - Tertiary aliphatic/aromatic amine - Aryl ketone - Aniline or substituted anilines - Dialkylarylamine - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Vinylogous acid - Azole - Pyrrole - Thiazole - Thiadiazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Ketone - Lactam - Tertiary amine - Enol - Carboxylic acid derivative - Sulfenyl compound - Thioether - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic 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