Compound Identification
SMILES
Cl.COC(=O)C[C@@H]1C[C@@H](COC2=NN=C(C=C2)C2=CC=C(C=C2)C(N)=N)N(CCCC2=CC=C(SC)C=C2)C1=O
InChIKey
InChIKey=PTJASEGJGVZPBR-SJEIDVEUSA-N
Formula
C29H34ClN5O4S
Mass
584.13
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
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Subclass
Pyridazines and derivatives
- Level 5 Phenylpyridazines
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Subclass
Pyridazines and derivatives
-
Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyridazines and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyridazines
Alternative Parents
Thiophenol ethers Alkyl aryl ethers Alkylarylthioethers Pyrrolidine-2-ones N-alkylpyrrolidines Benzene and substituted derivatives Tertiary carboxylic acid amides Methyl esters Heteroaromatic compounds Lactams Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboximidamides Carboxamidines Carbonyl compounds Hydrocarbon derivatives Hydrochlorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyridazine - Aryl thioether - Thiophenol ether - Alkyl aryl ether - Alkylarylthioether - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - N-alkylpyrrolidine - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Methyl ester - Pyrrolidine - Carboxylic acid ester - Lactam - Carboxamide group - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Ether - Azacycle - Monocarboxylic acid or derivatives - Sulfenyl compound - Carboximidamide - Thioether - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrochloride - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyridazines. These are organic compounds containing a pyridazine ring substituted by a phenyl group.
External Descriptors
Not available