Compound Identification
SMILES
OC[C@@H]1C[C@@]1(CO)CN1C=C(C=CI)C(=O)NC1=O
InChIKey
InChIKey=MIJSVRRTSWPTMV-CABZTGNLSA-N
Formula
C12H15IN2O4
Mass
378.166
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyrimidones
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Subclass
Pyrimidines and pyrimidine derivatives
-
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
Pyrimidones
Alternative Parents
N-acyl amines Hydropyrimidines Vinylogous amides Heteroaromatic compounds Dicarboximides Organic carbonic acids and derivatives Lactams Vinyl iodides Iodoalkenes Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organoiodides Organic oxides Hydrocarbon derivatives Alcohols and polyols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidone - N-acyl-amine - 1,2,3,4-tetrahydropyrimidine - Hydropyrimidine - Heteroaromatic compound - Vinylogous amide - Dicarboximide - Carbonic acid derivative - Lactam - Azacycle - Iodoalkene - Haloalkene - Vinyl iodide - Vinyl halide - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available