Compound Identification
SMILES
COC1=CC=CC(CN2CCN3C(=O)C=C(OC)C(C(=O)NCC4=CSC=C4)=C3CC2)=C1
InChIKey
InChIKey=PICJVTUUZAMOKG-UHFFFAOYSA-N
Formula
C24H27N3O4S
Mass
453.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyridodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridodiazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyridodiazepines
Alternative Parents
Pyridinecarboxylic acids and derivatives Anisoles Phenylmethylamines Phenoxy compounds Methoxybenzenes Benzylamines Alkyl aryl ethers Pyridinones Aralkylamines Vinylogous esters Vinylogous amides Thiophenes Heteroaromatic compounds Trialkylamines Amino acids and derivatives Secondary carboxylic acid amides Lactams Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrido-para-diazepine - Pyridine carboxylic acid or derivatives - Phenoxy compound - Anisole - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Pyridinone - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Vinylogous ester - Vinylogous amide - Thiophene - Amino acid or derivatives - Tertiary amine - Secondary carboxylic acid amide - Tertiary aliphatic amine - Carboxamide group - Lactam - Azacycle - Ether - Carboxylic acid derivative - Amine - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridodiazepines. These are heterocyclic compounds containing a pyridine fused to a diazepine ring. Pyridine is 6-membered ring consisting of five carbon atoms and a nitrogen atom. Diazepine is a 7-membered ring consisting of five carbon atoms and two nitrogen centers.
External Descriptors
Not available