Compound Identification
SMILES
CC1=CSC(=N1)C1=NN=C(NC2=CC=C(OC3=C(C=CC=N3)C3=NC(NCCCO)=NC=C3)C=C2)C2=CC=CC=C12
InChIKey
InChIKey=XKRCGQUJYOBXKI-UHFFFAOYSA-N
Formula
C30H26N8O2S
Mass
562.65
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyridinylpyrimidines
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinylpyrimidines
Alternative Parents
Diarylethers Phthalazines Phenoxy compounds Phenol ethers Aniline and substituted anilines Aminopyrimidines and derivatives Aminopyridazines 2,4-disubstituted thiazoles Pyridines and derivatives Imidolactams Heteroaromatic compounds Azacyclic compounds Alkanolamines Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridinylpyrimidine - Diaryl ether - Phthalazine - Phenoxy compound - Phenol ether - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Aminopyridazine - Aminopyrimidine - Monocyclic benzene moiety - Imidolactam - Pyridazine - Pyridine - Benzenoid - Heteroaromatic compound - Azole - Thiazole - Azacycle - Ether - Alkanolamine - Alcohol - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Primary alcohol - Amine - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpyrimidines. These are compounds containing a pyridinylpyrimidine skeleton, which consists of a pyridine linked (not fused) to a pyrimidine by a bond.
External Descriptors
Not available