Compound Identification
SMILES
Cl.Cl.NC(=N)N(Cl)C1=C2C=CC(=CC2=CN=C1)S(=O)(=O)N(CC1CCCCC1)CC(O)=O
InChIKey
InChIKey=YXVMZVOAPFQJHC-UHFFFAOYSA-N
Formula
C19H26Cl3N5O4S
Mass
526.86
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolines and derivatives
Alternative Parents
Alpha amino acids and derivatives Pyridines and derivatives Organosulfonamides Benzenoids Aminosulfonyl compounds Heteroaromatic compounds Guanidines Azacyclic compounds Monocarboxylic acids and derivatives Carboximidamides Carboxylic acids Organopnictogen compounds Carbonyl compounds Organic oxides Imines Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Isoquinoline - Pyridine - Organosulfonic acid amide - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Heteroaromatic compound - Guanidine - Carboxylic acid derivative - Carboxylic acid - Azacycle - Carboximidamide - Monocarboxylic acid or derivatives - Carbonyl group - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Imine - Organic nitrogen compound - Hydrocarbon derivative - Hydrochloride - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine.
External Descriptors
Not available