Compound Identification
SMILES
COC1=CC=C(CN2C=CN=C2C2CCN(CC2)C(=O)C2=C(OC)C=C(SC)C=C2)C=C1
InChIKey
InChIKey=OTJHRECNQWKTJC-UHFFFAOYSA-N
Formula
C25H29N3O3S
Mass
451.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoyl derivatives
- Level 5 1-benzoylpiperidines
-
Subclass
Benzoyl derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoyl derivatives
Intermediate Tree Nodes
Not available
Direct Parent
1-benzoylpiperidines
Alternative Parents
N-benzoylpiperidines P-sulfanylbenzoic acids and derivatives Benzamides Phenoxy compounds Thiophenol ethers Methoxybenzenes Anisoles Alkyl aryl ethers Alkylarylthioethers N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Azacyclic compounds Sulfenyl compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-benzoylpiperidine - 1-benzoylpiperidine - P-sulfanylbenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - N-acyl-piperidine - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Phenol ether - Thiophenol ether - Alkyl aryl ether - Alkylarylthioether - N-substituted imidazole - Piperidine - Azole - Imidazole - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Ether - Carboxylic acid derivative - Sulfenyl compound - Thioether - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organopnictogen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzoylpiperidines. These are compounds containing a piperidine ring substituted at the 1-position with a benzoyl group.
External Descriptors
Not available