Compound Identification
SMILES
COC1=CC=C(C=C1)C(=O)N1CCN(CC1)C1=CC=C(NC(=O)CSC2=NN=C(O2)C2=CC=C(Br)C=C2)C=C1
InChIKey
InChIKey=AKQRRWJHAIKYRG-UHFFFAOYSA-N
Formula
C28H26BrN5O4S
Mass
608.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
-
Subclass
Piperazines
- Level 5 Phenylpiperazines
-
Subclass
Piperazines
-
Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpiperazines
Alternative Parents
N-arylpiperazines Anilides Benzamides Aniline and substituted anilines Anisoles Benzoyl derivatives Dialkylarylamines Methoxybenzenes N-arylamides Phenoxy compounds Bromobenzenes Alkylarylthioethers Alkyl aryl ethers Aryl bromides Heteroaromatic compounds Tertiary carboxylic acid amides 1,3,4-oxadiazoles Amino acids and derivatives Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpiperazine - N-arylpiperazine - Benzamide - Benzoic acid or derivatives - Anilide - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Aryl thioether - Tertiary aliphatic/aromatic amine - N-arylamide - Dialkylarylamine - Aniline or substituted anilines - Methoxybenzene - Alkylarylthioether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - 1,3,4-oxadiazole - Oxadiazole - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ether - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Thioether - Oxacycle - Organonitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organosulfur compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organohalogen compound - Organobromide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.
External Descriptors
Not available