Compound Identification
SMILES
CCOC(=O)N1CC[NH+](CC2=CSC(NC3=CC(C)=C(C)C=C3)=N2)CC1
InChIKey
InChIKey=CXUWUJKLJDPQJT-UHFFFAOYSA-O
Formula
C19H27N4O2S
Mass
375.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
- Subclass Piperazines
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Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Piperazine carboxylic acids and derivatives
Direct Parent
Piperazine carboxylic acids
Alternative Parents
o-Xylenes Aniline and substituted anilines N-alkylpiperazines Aralkylamines 2,4-disubstituted thiazoles 2-amino-1,3-thiazoles Quaternary ammonium salts Heteroaromatic compounds Carbamate esters Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Piperazine-1-carboxylic acid - O-xylene - Xylene - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - N-alkylpiperazine - Aralkylamine - Monocyclic benzene moiety - Benzenoid - 1,3-thiazol-2-amine - Azole - Quaternary ammonium salt - Thiazole - Carbamic acid ester - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Azacycle - Amine - Organic oxide - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as piperazine carboxylic acids. These are heterocyclic compounds containing a piperazine ring substituted by one or more carboxylic acid groups.
External Descriptors
Not available