Compound Identification
SMILES
NC(=O)C1=C(SCC2=CC=CC=C2Cl)SC2=C1NC(=O)C1CCCN1C2=O
InChIKey
InChIKey=LBABXDLGBRIONL-UHFFFAOYSA-N
Formula
C18H16ClN3O3S2
Mass
421.91
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
Alpha amino acids and derivatives Thiophene carboxamides 2-heteroaryl carboxamides 1,4-diazepines Alkylarylthioethers Chlorobenzenes Vinylogous thioesters Aryl chlorides Vinylogous amides Tertiary carboxylic acid amides Pyrrolidines Heteroaromatic compounds Tertiary amines Secondary carboxylic acid amides Primary carboxylic acid amides Lactams Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Thieno-para-diazepine - 2-heteroaryl carboxamide - Aryl thioether - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Para-diazepine - Halobenzene - Chlorobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Vinylogous thioester - Benzenoid - Pyrrolidine - Thiophene - Tertiary carboxylic acid amide - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Lactam - Primary carboxylic acid amide - Tertiary amine - Secondary carboxylic acid amide - Thioether - Sulfenyl compound - Carboxylic acid derivative - Azacycle - Organochloride - Organohalogen compound - Amine - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxide - 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