Compound Identification
SMILES
CN1C2CCC1C1=C(C2)C(C#N)=C(N)S1
InChIKey
InChIKey=IORDZQPJBGXYHE-UHFFFAOYSA-N
Formula
C11H13N3S
Mass
219.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Cycloheptathiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Cycloheptathiophenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cycloheptathiophenes
Alternative Parents
3,4,5-trisubstituted-2-aminothiophenes Aralkylamines N-alkylpyrrolidines Heteroaromatic compounds Trialkylamines Nitriles Azacyclic compounds Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cycloheptathiophene - 3,4,5-trisubstituted-2-aminothiophene - Aralkylamine - 2-aminothiophene - N-alkylpyrrolidine - Pyrrolidine - Heteroaromatic compound - Thiophene - Tertiary amine - Tertiary aliphatic amine - Carbonitrile - Nitrile - Azacycle - Primary amine - Organonitrogen compound - Amine - Cyanide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cycloheptathiophenes. These are polycyclic compounds containing a thiophene ring fused to a 7 member carbocyclic moiety. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom.
External Descriptors
Not available