Compound Identification
SMILES
COC1=C(OCCN2C=NN=N2)C=C2N=CC(C#N)=C(N3CCN(CC3)C(=O)NC3=CC=C(OC(C)C)C=C3)C2=C1
InChIKey
InChIKey=BWDVZQWLKFKFMW-UHFFFAOYSA-N
Formula
C28H31N9O4
Mass
557.615
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazinanes
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Subclass
Piperazines
- Level 5 Pyridinylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinylpiperazines
Alternative Parents
N-arylpiperazines 4-aminoquinolines N-phenylureas Piperazine carboxamides Phenoxy compounds Dialkylarylamines Anisoles Alkyl aryl ethers Aminopyridines and derivatives Tetrazoles Heteroaromatic compounds Ureas Nitriles Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - 4-aminoquinoline - Aminoquinoline - N-phenylurea - Quinoline - Piperazine-1-carboxamide - Phenol ether - Phenoxy compound - Anisole - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Alkyl aryl ether - Aminopyridine - Pyridine - Benzenoid - Monocyclic benzene moiety - Tetrazole - Azole - Heteroaromatic compound - Urea - Tertiary amine - Azacycle - Ether - Carbonitrile - Nitrile - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Cyanide - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a ring.
External Descriptors
Not available