Compound Identification
SMILES
CC1=CC=C(CSC2=NN=C(S2)N2C(C(C(=O)C3=CC=CS3)=C(O)C2=O)C2=CC(OCC=C)=CC=C2)C=C1
InChIKey
InChIKey=DNAWSGSHDSLAIS-UHFFFAOYSA-N
Formula
C28H23N3O4S3
Mass
561.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolines
- Subclass Phenylpyrrolines
-
Class
Pyrrolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolines
Subclass
Phenylpyrrolines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolines
Alternative Parents
Aryl ketones Phenol ethers Phenoxy compounds Pyrroline carboxylic acids and derivatives Alkyl aryl ethers Toluenes Alkylarylthioethers Vinylogous acids Thiophenes Thiadiazoles Heteroaromatic compounds Tertiary carboxylic acid amides Pyrroles Lactams Enols Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - Phenoxy compound - Aryl thioether - Phenol ether - Pyrroline carboxylic acid or derivatives - Aryl ketone - Alkyl aryl ether - Toluene - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Azole - Pyrrole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiadiazole - Thiophene - Vinylogous acid - Carboxamide group - Ketone - Lactam - Carboxylic acid derivative - Sulfenyl compound - Azacycle - Thioether - Enol - Ether - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - 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