Compound Identification
SMILES
Cl.CC(C)C(N1CCN(CC1)C(=O)C1=CC=CO1)C1=NN=NN1CS(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=IFLIEVSRKCJSNM-UHFFFAOYSA-N
Formula
C22H29ClN6O4S
Mass
509.02
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
- Level 5 Tosyl compounds
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Subclass
Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Tosyl compounds
Alternative Parents
Benzenesulfonyl compounds 2-heteroaryl carboxamides Furoic acid and derivatives Aralkylamines N-alkylpiperazines Tetrazoles Tertiary carboxylic acid amides Sulfones Heteroaromatic compounds Trialkylamines Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Tosyl compound - Benzenesulfonyl group - Furoic acid or derivatives - 2-heteroaryl carboxamide - N-alkylpiperazine - Aralkylamine - Piperazine - 1,4-diazinane - Furan - Sulfone - Sulfonyl - Azole - Tetrazole - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Carboxamide group - Tertiary aliphatic amine - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Organosulfur compound - Hydrochloride - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as tosyl compounds. These are organosulfur compounds containing a tosyl group, with the general formula CH3C6H4S(O2)R (R = any atom).
External Descriptors
Not available