Compound Identification
SMILES
CC(OCCS(=O)(=O)C1=CC=CC=C1)C1=NC(=CS1)C1=NC=C2N=CN=C(NC3=CC(Cl)=C(OCC4=CC(F)=CC=C4)C=C3)C2=C1
InChIKey
InChIKey=UUFJUBGPGOLTEZ-UHFFFAOYSA-N
Formula
C33H27ClFN5O4S2
Mass
676.18
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridopyrimidines
- Subclass Pyrido[3,4-d]pyrimidines
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Class
Pyridopyrimidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridopyrimidines
Subclass
Pyrido[3,4-d]pyrimidines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrido[3,4-d]pyrimidines
Alternative Parents
Benzenesulfonyl compounds Phenoxy compounds Phenol ethers Aniline and substituted anilines 2,4-disubstituted thiazoles Alkyl aryl ethers Aminopyrimidines and derivatives Fluorobenzenes Chlorobenzenes Pyridines and derivatives Aryl chlorides Imidolactams Aryl fluorides Sulfones Heteroaromatic compounds Azacyclic compounds Secondary amines Dialkyl ethers Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrido[3,4-d]pyrimidine - Benzenesulfonyl group - Phenol ether - Phenoxy compound - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Aminopyrimidine - Chlorobenzene - Fluorobenzene - Halobenzene - Imidolactam - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Thiazole - Sulfonyl - Sulfone - Azole - Secondary amine - Azacycle - Dialkyl ether - Ether - Organosulfur compound - Amine - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrido[3,4-d]pyrimidines. These are compounds containing the pyrido[3,4-d]pyrimidine ring system, which is a pyridopyrimidine isomer with three ring nitrogen atoms at the 1-, 3-, and 7- position.
External Descriptors
Not available