Compound Identification
SMILES
COC1(CC1)C(=O)N[C@@H](C1=CN=CN1C)C1=CC2=C(N=CC=C2)[C@@H](N2CCN(CC2)C(=O)OC2CCN(CC2)S(C)(=O)=O)C2=C1C=C(Cl)C=C2
InChIKey
InChIKey=MMASGZVOIAJZLM-ZWXJPIIXSA-N
Formula
C35H42ClN7O6S
Mass
724.27
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzocycloheptapyridines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzocycloheptapyridines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzocycloheptapyridines
Alternative Parents
Piperazine carboxylic acids Aralkylamines N-alkylpiperazines Aryl chlorides Benzenoids Cyclopropanecarboxylic acids and derivatives N-substituted imidazoles Organic sulfonamides Organosulfonamides Piperidines Pyridines and derivatives Sulfonyls Heteroaromatic compounds Carbamate esters Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - Piperazine-1-carboxylic acid - N-alkylpiperazine - Aralkylamine - Aryl chloride - Aryl halide - Cyclopropanecarboxylic acid or derivatives - 1,4-diazinane - N-substituted imidazole - Piperazine - Piperidine - Pyridine - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Heteroaromatic compound - Organic sulfonic acid or derivatives - Carbamic acid ester - Sulfonyl - Organosulfonic acid or derivatives - Azole - Imidazole - Carboxamide group - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Ether - Dialkyl ether - Carboxylic acid derivative - Azacycle - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzocycloheptapyridines. These are aromatic compounds containing a benzene ring and a pyridine ring fused to a seven membered carbocycle.
External Descriptors
Not available