Compound Identification
SMILES
OC(=O)\C=C\C(O)=O.CC(=O)C1=CC2=C(SC3=CC=CC=C3N2CCCN2CCN(CCO)CC2)C=C1
InChIKey
InChIKey=JVMBOHDUHCHGOE-WLHGVMLRSA-N
Formula
C27H33N3O6S
Mass
527.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiazines
- Subclass Phenothiazines
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Class
Benzothiazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazines
Subclass
Phenothiazines
Intermediate Tree Nodes
Not available
Direct Parent
Phenothiazines
Alternative Parents
Alkyldiarylamines Diarylthioethers Acetophenones Aryl alkyl ketones N-alkylpiperazines Unsaturated fatty acids Dicarboxylic acids and derivatives 1,4-thiazines Trialkylamines 1,2-aminoalcohols Carboxylic acids Azacyclic compounds Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Phenothiazine - Alkyldiarylamine - Diarylthioether - Acetophenone - Aryl thioether - Tertiary aliphatic/aromatic amine - Aryl ketone - Aryl alkyl ketone - N-alkylpiperazine - Dicarboxylic acid or derivatives - Fatty acyl - Fatty acid - 1,4-diazinane - Benzenoid - Unsaturated fatty acid - Piperazine - Para-thiazine - Ketone - 1,2-aminoalcohol - Tertiary aliphatic amine - Tertiary amine - Azacycle - Alkanolamine - Carboxylic acid derivative - Thioether - Carboxylic acid - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Primary alcohol - Carbonyl group - Amine - Organic nitrogen compound - Alcohol - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenothiazines. These are polycyclic aromatic compounds containing a phenothiazine moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a para-thiazine ring.
External Descriptors
Not available