Compound Identification
SMILES
O=C(CN1C2=C(C3=C(CCCC3)S2)C(=NCC1=O)C1=CC=CS1)N1CCOCC1
InChIKey
InChIKey=UWPDAYWUFMLAQW-UHFFFAOYSA-N
Formula
C21H23N3O3S2
Mass
429.55
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 1,4-diazepines Morpholines Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Lactams Ketimines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Thieno-para-diazepine - Para-diazepine - Morpholine - Oxazinane - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiophene - Carboxamide group - Ketimine - Lactam - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Imine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen 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