Compound Identification
SMILES
NC(=O)C1=NN(C2=C1CCN(C2=O)C1=CC=C(C=C1)C1(CN2CCCC2)CC1)C1=CC2=C(ON=C2N)C=C1
InChIKey
InChIKey=YCUYOIFXHNLFAX-UHFFFAOYSA-N
Formula
C28H29N7O3
Mass
511.586
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzisoxazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzisoxazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzisoxazoles
Alternative Parents
Pyridinecarboxamides 2-heteroaryl carboxamides Pyrazole-5-carboxamides Aralkylamines Benzene and substituted derivatives Imidolactams N-alkylpyrrolidines Tertiary carboxylic acid amides Heteroaromatic compounds Isoxazoles Lactams Trialkylamines Amino acids and derivatives Primary carboxylic acid amides Azacyclic compounds Oxacyclic compounds Primary amines Hydrocarbon derivatives Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzisoxazole - Pyridinecarboxamide - 2-heteroaryl carboxamide - Pyrazole-5-carboxamide - Aralkylamine - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Imidolactam - Azole - Isoxazole - Pyrazole - Pyrrolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Tertiary aliphatic amine - Carboxamide group - Amino acid or derivatives - Lactam - Primary carboxylic acid amide - Tertiary amine - Carboxylic acid derivative - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Primary amine - Organic oxide - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzisoxazoles. These are aromatic compounds containing a benzene ring fused to an isoxazole ring. Isoxazole is five-membered ring with three carbon atoms, and an oxygen atom next to a nitrogen atom.
External Descriptors
Not available