Compound Identification
SMILES
CC(C)(C)OC(=O)N1CCN(CC1)C1=C(NC(=O)C2=CC=CC(=N2)C2=CC=C(S2)C2=CC=CC=C2)C=NC=C1
InChIKey
InChIKey=DJXTVTXTUQKDOO-UHFFFAOYSA-N
Formula
C30H31N5O3S
Mass
541.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
-
Subclass
Piperazines
- Level 5 Pyridinylpiperazines
-
Subclass
Piperazines
-
Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinylpiperazines
Alternative Parents
N-arylpiperazines Pyridinecarboxylic acids and derivatives Piperazine carboxylic acids Dialkylarylamines 2-heteroaryl carboxamides Aminopyridines and derivatives 2,5-disubstituted thiophenes Benzene and substituted derivatives Heteroaromatic compounds Carbamate esters Secondary carboxylic acid amides Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-arylpiperazine - Pyridinylpiperazine - Piperazine-1-carboxylic acid - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Dialkylarylamine - Aminopyridine - 2,5-disubstituted thiophene - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Carbamic acid ester - Thiophene - Amino acid or derivatives - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organic oxide - Organooxygen compound - Organonitrogen compound - Amine - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a ring.
External Descriptors
Not available