Compound Identification
SMILES
CC(C)C1=CC=C(C=C1)C1N(CCN2CCOCC2)C(=O)C(O)=C1C(=O)C1=C(C)N2C(S1)=NC1=CC=CC=C21
InChIKey
InChIKey=KGHZJGGMZKOSSK-UHFFFAOYSA-N
Formula
C30H32N4O4S
Mass
544.67
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
Aromatic monoterpenoids Benzimidazoles Cumenes Phenylpropanes Aryl ketones Pyrroline carboxylic acids and derivatives Morpholines N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Thiazoles Vinylogous acids Tertiary carboxylic acid amides Pyrroles Amino acids and derivatives Lactams Trialkylamines Oxacyclic compounds Enols Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Monoterpenoid - P-cymene - Aromatic monoterpenoid - Benzimidazole - Cumene - Phenylpropane - Aryl ketone - Pyrroline carboxylic acid or derivatives - Morpholine - N-substituted imidazole - Monocyclic benzene moiety - Oxazinane - Benzenoid - Imidazole - Azole - Heteroaromatic compound - Vinylogous amide - Vinylogous acid - Thiazole - Tertiary carboxylic acid amide - Pyrrole - Ketone - Tertiary aliphatic amine - Lactam - Amino acid or derivatives - Carboxamide group - Tertiary amine - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Enol - Ether - Carbonyl group - Organic nitrogen compound - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen 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