Compound Identification
SMILES
CC1=CC(OC[C@H](O)CO)=CC(C)=C1C1=C(C)C(CNC2=CC(F)=C(CCC3=NNN=N3)C=C2)=CC=C1
InChIKey
InChIKey=VCTLXZMMUPTODG-HSZRJFAPSA-N
Formula
C28H32FN5O3
Mass
505.594
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
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbenzamines
Alternative Parents
Biphenyls and derivatives m-Xylenes Aniline and substituted anilines Phenylalkylamines Phenoxy compounds Phenol ethers Benzylamines Toluenes Secondary alkylarylamines Alkyl aryl ethers Fluorobenzenes Aryl fluorides Tetrazoles Heteroaromatic compounds 1,2-diols Secondary alcohols Azacyclic compounds Organofluorides Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbenzamine - Biphenyl - Benzylamine - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - Phenoxy compound - Xylene - M-xylene - Alkyl aryl ether - Aralkylamine - Toluene - Secondary aliphatic/aromatic amine - Fluorobenzene - Halobenzene - Aryl halide - Aryl fluoride - Tetrazole - Heteroaromatic compound - Azole - Secondary alcohol - 1,2-diol - Organoheterocyclic compound - Secondary amine - Azacycle - Ether - Organic nitrogen compound - Alcohol - Primary alcohol - Organic oxygen compound - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organofluoride - Aromatic heteromonocyclic 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