Compound Identification
SMILES
CSC1=CC=CC(CC#CC2=CC3=C(C=N2)N=CN(CC2=CC=C(C=C2)S(C)(=O)=O)C3=O)=C1
InChIKey
InChIKey=LSBNRCWAPPKCKR-UHFFFAOYSA-N
Formula
C25H21N3O3S2
Mass
475.58
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 Thiophenol ethers Pyrimidones Alkylarylthioethers Pyridines and derivatives Sulfones Heteroaromatic compounds Lactams Sulfenyl compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrido[3,4-d]pyrimidine - Benzenesulfonyl group - Aryl thioether - Thiophenol ether - Pyrimidone - Alkylarylthioether - Monocyclic benzene moiety - Pyridine - Pyrimidine - Benzenoid - Sulfonyl - Sulfone - Heteroaromatic compound - Lactam - Sulfenyl compound - Thioether - Azacycle - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - 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