Compound Identification
SMILES
CC1=CN2C(=O)C3=C(N=C2C=C1)N(CC1=CC=CO1)C(=N)C(=C3)C#N
InChIKey
InChIKey=IFDDKXIRNYVOOD-UHFFFAOYSA-N
Formula
C18H13N5O2
Mass
331.335
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[2,3-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[2,3-d]pyrimidines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrido[2,3-d]pyrimidines
Alternative Parents
Pyrimidones Methylpyridines Imidolactams Vinylogous amides Heteroaromatic compounds Furans Lactams Oxacyclic compounds Nitriles Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrido[2,3-d]pyrimidine - Pyrimidone - Methylpyridine - Pyridine - Pyrimidine - Imidolactam - Furan - Vinylogous amide - Heteroaromatic compound - Lactam - Oxacycle - Azacycle - Nitrile - Carbonitrile - Cyanide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrido[2,3-d]pyrimidines. These are compounds containing the pyrido[2,3-d]pyrimidine ring system, which is a pyridopyrimidine isomer with three ring nitrogen atoms at the 1-, 3-, and 8- position.
External Descriptors
Not available