Compound Identification
SMILES
CSC1=C(C=C(C=C1)C(=O)N1CCC(CC1)C1=NC=CN1CCC1=CSC=C1)[N+]([O-])=O
InChIKey
InChIKey=BOBBCAYYMXJGLR-UHFFFAOYSA-N
Formula
C22H24N4O3S2
Mass
456.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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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 Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organooxygen compounds Organonitrogen compounds Organopnictogen compounds 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 - Imidazole - Heteroaromatic compound - Thiophene - Azole - Tertiary carboxylic acid amide - Organic nitro compound - Carboxamide group - C-nitro compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Azacycle - Organic oxoazanium - Thioether - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - 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