Compound Identification
SMILES
COCCNC1=NC(SCC2=CC=C(C=C2)S(=O)(=O)C2CNCCO2)=NC(NC2=NNC(C)=C2)=C1
InChIKey
InChIKey=GSHVXAPSPQELCM-UHFFFAOYSA-N
Formula
C22H29N7O4S2
Mass
519.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzenesulfonyl compounds
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonyl compounds
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonyl compounds
Alternative Parents
Aminopyrimidines and derivatives Alkylarylthioethers Morpholines Imidolactams Sulfones Pyrazoles Monothioacetals Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Dialkylamines Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzenesulfonyl group - Aryl thioether - Aminopyrimidine - Alkylarylthioether - Morpholine - Oxazinane - Pyrimidine - Imidolactam - Azole - Monothioacetal - Pyrazole - Sulfone - Sulfonyl - Heteroaromatic compound - Dialkyl ether - Azacycle - Secondary amine - Organoheterocyclic compound - Oxacycle - Secondary aliphatic amine - Sulfenyl compound - Thioether - Ether - Amine - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.
External Descriptors
Not available