Compound Identification
SMILES
CC1=C(C)C2=C(S1)N=C(N=C2Cl)C1=CN=CC=C1.CC1=C(C)C2=C(NCC3=CC=CC=C3)N=C(N=C2S1)C1=CN=CC=C1
InChIKey
InChIKey=QZHJOFPREFBFIR-UHFFFAOYSA-N
Formula
C33H28ClN7S2
Mass
622.21
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
Thienopyrimidines Benzylamines Secondary alkylarylamines Halopyrimidines Aminopyrimidines and derivatives Pyridines and derivatives Imidolactams Aryl chlorides Thiophenes Heteroaromatic compounds Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Pyridinylpyrimidine - Thienopyrimidine - Benzylamine - Aminopyrimidine - Halopyrimidine - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Imidolactam - Benzenoid - Heteroaromatic compound - Thiophene - Azacycle - Secondary amine - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Amine - Organic nitrogen 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