Compound Identification
SMILES
Cl.CC1=CC(OCC(O)CNC(C)(C)C)=C(Cl)C=C1.NC1=NC2=C(N=C(C(N)=N2)C2=CC=CC=C2)C(N)=N1.CC(C1NC2=CC(Cl)=C(C=C2S(=O)(=O)N1)S(N)(=O)=O)C1=CC=CC=C1
InChIKey
InChIKey=KREKTYXLRXLLNX-UHFFFAOYSA-N
Formula
C41H50Cl3N11O6S2
Mass
963.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiadiazines
- Subclass Benzothiadiazines
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Class
Thiadiazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiadiazines
Subclass
Benzothiadiazines
Intermediate Tree Nodes
Not available
Direct Parent
1,2,4-benzothiadiazine-1,1-dioxides
Alternative Parents
Pteridines and derivatives Phenoxy compounds Phenol ethers Toluenes Secondary alkylarylamines Chlorobenzenes Aminopyrimidines and derivatives Aminopyrazines Alkyl aryl ethers Organosulfonamides Imidolactams Aryl chlorides Heteroaromatic compounds Aminosulfonyl compounds Secondary alcohols 1,2-aminoalcohols Dialkylamines Azacyclic compounds Primary amines Organopnictogen compounds Organochlorides Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
1,2,4-benzothiadiazine-1,1-dioxide - Pteridine - Phenoxy compound - Phenol ether - Toluene - Secondary aliphatic/aromatic amine - Halobenzene - Chlorobenzene - Aminopyrimidine - Aminopyrazine - Alkyl aryl ether - Imidolactam - Benzenoid - Organosulfonic acid amide - Pyrimidine - Pyrazine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Secondary amine - Ether - Secondary aliphatic amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,2,4-benzothiadiazine-1,1-dioxides. These are aromatic heterocyclic compounds containing a 1,2,4-benzothiadiazine ring system with two S=O bonds at the 1-position.
External Descriptors
Not available