Compound Identification
SMILES
CCNC1=CC=CC=C1CNC1=C(CNC(=O)C(OCC)N2CC3=C(C=CC=C3F)C2=O)C=CC(=C1)C(N)=N
InChIKey
InChIKey=VPISZZNANDZIHC-UHFFFAOYSA-N
Formula
C29H33FN6O3
Mass
532.62
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Phenylmethylamines
- Level 5 Phenylbenzamines
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Subclass
Phenylmethylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbenzamines
Alternative Parents
Alpha amino acids and derivatives Isoindolones Isoindoles Aniline and substituted anilines Benzylamines Phenylalkylamines Secondary alkylarylamines Aryl fluorides Tertiary carboxylic acid amides Lactams Secondary carboxylic acid amides Carboximidamides Carboxamidines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbenzamine - Alpha-amino acid or derivatives - Isoindolone - Isoindole or derivatives - Isoindole - Isoindoline - Benzylamine - Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Aralkylamine - Aryl halide - Aryl fluoride - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Lactam - Amino acid or derivatives - Carboxamide group - Amidine - Azacycle - Carboxylic acid amidine - Organoheterocyclic compound - Carboxylic acid derivative - Carboximidamide - Secondary amine - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
External Descriptors
Not available