Compound Identification
SMILES
CC1(C)NN(C2CN3C(=CNC=C3C3=CC=CC=C3Cl)C3=C(SC=C3)N12)C(=O)C1CC1
InChIKey
InChIKey=CSZRVVJNYSIGRP-UHFFFAOYSA-N
Formula
C23H24ClN5OS
Mass
453.99
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thienodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thienodiazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thienodiazepines
Alternative Parents
Dialkylarylamines 1,4-diazepines Chlorobenzenes 2-aminothiophenes Aryl chlorides Cyclopropanecarboxylic acids and derivatives Triazolidines Heteroaromatic compounds Trialkylamines Amino acids and derivatives Carboxylic acid hydrazides Enamines Azacyclic compounds Dialkylamines Organochlorides Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thieno-para-diazepine - Dialkylarylamine - Para-diazepine - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Cyclopropanecarboxylic acid or derivatives - Monocyclic benzene moiety - 2-aminothiophene - Benzenoid - Heteroaromatic compound - Triazolidine - Thiophene - Carboxylic acid hydrazide - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Secondary amine - Secondary aliphatic amine - Enamine - Organooxygen compound - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thienodiazepines. These are heteropolycyclic containing a thiophene ring fused to a diazepine ring. Thiophene is 5-membered ring consisting of four carbon and one sulfur atoms. Diazepine is a 7-membered ring consisting of five carbon and two nitrogen atoms.
External Descriptors
Not available