Compound Identification
SMILES
CC1=CC=CN2C(=O)C3=C(N=C12)N(CC1CCCO1)C(=N)C(=C3)C(N)=S
InChIKey
InChIKey=IRBQARAELIIWEN-UHFFFAOYSA-N
Formula
C18H19N5O2S
Mass
369.44
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
Methylpyridines Pyrimidones Imidolactams Thioamides Oxolanes Vinylogous amides Heteroaromatic compounds Lactams Thiocarboxylic acid amides Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Thiocarbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrido[2,3-d]pyrimidine - Methylpyridine - Pyrimidone - Pyridine - Imidolactam - Pyrimidine - Oxolane - Heteroaromatic compound - Vinylogous amide - Thioamide - Lactam - Dialkyl ether - Ether - Oxacycle - Azacycle - Thiocarboxylic acid amide - Organic nitrogen compound - Thiocarbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - 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