Compound Identification
SMILES
CCOC1=CC=C(C=C1)N1C(=O)C2=CC=CC=C2N=C1[C@@H](C)N(CC1=CN=CC=C1)C(=O)CN1CCN(CCC(F)(F)F)CC1
InChIKey
InChIKey=KLHKGNPUOPBYAP-XMMPIXPASA-N
Formula
C33H37F3N6O3
Mass
622.693
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazanaphthalenes
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Subclass
Benzodiazines
- Level 5 Quinazolines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Not available
Direct Parent
Quinazolines
Alternative Parents
Alpha amino acids and derivatives N-piperazineacetamides Phenol ethers Phenoxy compounds Alkyl aryl ethers N-alkylpiperazines Pyrimidones Pyridines and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Lactams Trialkylamines Azacyclic compounds Alkyl fluorides Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - N-piperazineacetamide - Quinazoline - Phenoxy compound - Phenol ether - Alkyl aryl ether - N-alkylpiperazine - Pyrimidone - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Piperazine - Pyrimidine - Pyridine - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Lactam - Tertiary aliphatic amine - Tertiary amine - Azacycle - Ether - Carboxylic acid derivative - Organohalogen compound - Alkyl halide - Hydrocarbon derivative - Alkyl fluoride - Carbonyl group - Organic oxide - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.
External Descriptors
Not available