Compound Identification
SMILES
COCCOCN1C=CN=C1C1CCN(CC1)C(=O)C1=CC(=C(SC)C=C1)[N+]([O-])=O
InChIKey
InChIKey=APCVOWHFLCCSRJ-UHFFFAOYSA-N
Formula
C20H26N4O5S
Mass
434.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
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Subclass
Benzoyl derivatives
- Level 5 1-benzoylpiperidines
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Subclass
Benzoyl derivatives
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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 Nitrobenzenes Thiophenol ethers Nitroaromatic compounds Alkylarylthioethers N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Dialkyl ethers Sulfenyl compounds Organic oxoazanium compounds Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-benzoylpiperidine - 1-benzoylpiperidine - P-sulfanylbenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - N-acyl-piperidine - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Thiophenol ether - Alkylarylthioether - N-substituted imidazole - Piperidine - Azole - Imidazole - Heteroaromatic compound - Tertiary carboxylic acid amide - Organic nitro compound - Carboxamide group - C-nitro compound - Organoheterocyclic compound - Thioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic oxoazanium - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur 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